Cilnidipine.cdx
csChFnd80/10101813122D

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>  <Mol_ID> (1)
201

>  <Formula> (1)
C27H28N2O7

>  <MolWeight> (1)
492.52042

>  <Item Name> (1)
Cilnidipine

>  <Catalog Number> (1)
S1293

>  <Synonyms> (1)
FRC 8653 

>  <Target> (1)
Calcium Channel

>  <Form> (1)
Free Base

>  <URL> (1)
http://www.selleckchem.com/products/Cilnidipine.html

>  <CAS Number> (1)
132203-70-4

$$$$
Felodipine.cdx
csChFnd80/10101813122D

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M  END
>  <Mol_ID> (2)
209

>  <Formula> (2)
C18H19Cl2NO4

>  <MolWeight> (2)
384.25376

>  <Item Name> (2)
Felodipine (Plendil)

>  <Catalog Number> (2)
S1885

>  <Synonyms> (2)
Renedil, Feloday 

>  <Target> (2)
NULL

>  <Form> (2)
Free Base

>  <URL> (2)
http://www.selleckchem.com/products/Felodipine(Plendil).html

>  <CAS Number> (2)
72509-76-3

$$$$
Etomidate.cdx
csChFnd80/10101813122D

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>  <Mol_ID> (3)
257

>  <Formula> (3)
C14H16N2O2

>  <MolWeight> (3)
244.28904

>  <Item Name> (3)
Etomidate

>  <Catalog Number> (3)
S1329

>  <Synonyms> (3)
Amidate

>  <Target> (3)
GABA Receptor

>  <Form> (3)
Free Base

>  <URL> (3)
http://www.selleckchem.com/products/Etomidate.html

>  <CAS Number> (3)
33125-97-2

$$$$
Flumazenil.cdx
csChFnd80/10101813122D

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M  END
>  <Mol_ID> (4)
259

>  <Formula> (4)
C15H14FN3O3

>  <MolWeight> (4)
303.2883632

>  <Item Name> (4)
Flumazenil

>  <Catalog Number> (4)
S1332

>  <Synonyms> (4)
Flumazepil, Ro 15-1788, Anexate, Lanexat, Mazicon, Roma

>  <Target> (4)
GABA Receptor

>  <Form> (4)
Free Base

>  <URL> (4)
http://www.selleckchem.com/products/Flumazenil.html

>  <CAS Number> (4)
78755-81-4

$$$$
Ranolazine dihydrochloride.cdx
csChFnd80/10101813122D

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  2  7  1  0  0  0  0
  4  8  1  0  0  0  0
  3  9  1  0  0  0  0
  9 10  1  0  0  0  0
 10 11  2  0  0  0  0
 10 12  1  0  0  0  0
 12 13  1  0  0  0  0
 13 14  1  0  0  0  0
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 15 16  1  0  0  0  0
 16 17  1  0  0  0  0
 17 18  1  0  0  0  0
 18 13  1  0  0  0  0
 16 19  1  0  0  0  0
 19 20  1  0  0  0  0
 20 21  1  0  0  0  0
 22 23  2  0  0  0  0
 23 24  1  0  0  0  0
 24 25  1  0  0  0  0
 25 20  1  0  0  0  0
 22 26  1  0  0  0  0
 26 27  2  0  0  0  0
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 28 29  2  0  0  0  0
 29 23  1  0  0  0  0
 29 30  1  0  0  0  0
 30 31  1  0  0  0  0
M  END
>  <Mol_ID> (5)
315

>  <Formula> (5)
C24H35Cl2N3O4

>  <MolWeight> (5)
500.4584

>  <Item Name> (5)
Ranolazine dihydrochloride

>  <Catalog Number> (5)
S1425

>  <Synonyms> (5)
RS 43285-193, RS-43285, Ranexa, renolazine 

>  <Target> (5)
Calcium Channel

>  <Form> (5)
Dihydrochloride

>  <URL> (5)
http://www.selleckchem.com/products/Ranolazine-dihydrochloride.html

>  <CAS Number> (5)
95635-56-6

$$$$
Repaglinide.cdx
csChFnd80/10101813122D

 33 35  0  0  0  0  0  0  0  0999 V2000
    3.6247    3.4927    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    3.6247    2.0927    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    4.8371    1.3927    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    6.0496    2.0927    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    6.0496    3.4927    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    4.8371    4.1927    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    2.4165    4.1903    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
    1.2082    3.4927    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    0.0000    4.1903    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    2.4165    1.3951    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    1.2082    2.0927    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
    2.4165    0.0000    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
    7.2578    4.1903    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    8.4660    3.4927    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    9.6742    4.1903    0.0000 N   0  0  0  0  0  0  0  0  0  0  0  0
    8.4660    2.0976    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
   10.8825    3.4927    0.0000 C   0  0  2  0  0  0  0  0  0  0  0  0
   12.0907    4.1903    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   13.3031    3.4903    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   14.5156    4.1903    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   14.5156    5.5903    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   13.3031    6.2903    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
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   10.8825    6.2879    0.0000 N   0  0  0  0  0  0  0  0  0  0  0  0
   11.2448    7.6402    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   10.2549    8.6301    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    8.9026    8.2678    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    8.5402    6.9155    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    9.5302    5.9255    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   10.8825    2.0976    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   12.0907    1.4000    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   12.0907    0.0049    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   13.2989    2.0976    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
  1  2  2  0  0  0  0
  2  3  1  0  0  0  0
  3  4  2  0  0  0  0
  4  5  1  0  0  0  0
  5  6  2  0  0  0  0
  6  1  1  0  0  0  0
  1  7  1  0  0  0  0
  7  8  1  0  0  0  0
  8  9  1  0  0  0  0
  2 10  1  0  0  0  0
 10 11  1  0  0  0  0
 10 12  2  0  0  0  0
  5 13  1  0  0  0  0
 13 14  1  0  0  0  0
 14 15  1  0  0  0  0
 14 16  2  0  0  0  0
 15 17  1  0  0  0  0
 17 18  1  0  0  0  0
 18 19  2  0  0  0  0
 19 20  1  0  0  0  0
 20 21  2  0  0  0  0
 21 22  1  0  0  0  0
 22 23  2  0  0  0  0
 23 18  1  0  0  0  0
 23 24  1  0  0  0  0
 24 25  1  0  0  0  0
 25 26  1  0  0  0  0
 26 27  1  0  0  0  0
 27 28  1  0  0  0  0
 28 29  1  0  0  0  0
 29 24  1  0  0  0  0
 17 30  1  6  0  0  0
 30 31  1  0  0  0  0
 31 32  1  0  0  0  0
 31 33  1  0  0  0  0
M  END
>  <Mol_ID> (6)
316

>  <Formula> (6)
C27H36N2O4

>  <MolWeight> (6)
452.58574

>  <Item Name> (6)
Repaglinide

>  <Catalog Number> (6)
S1426

>  <Synonyms> (6)
Prandin, GlucoNorm, NovoNorm

>  <Target> (6)
Potassium Channel

>  <Form> (6)
Free Base

>  <URL> (6)
http://www.selleckchem.com/products/Repaglinide.html

>  <CAS Number> (6)
135062-02-1

$$$$
RILUZOLE (riluzole).cdx
csChFnd80/10101813122D

 15 16  0  0  0  0  0  0  0  0999 V2000
    3.5495    2.1000    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    3.5495    0.7000    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    4.7620    0.0000    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    5.9744    0.7000    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    5.9744    2.1000    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    4.7620    2.8000    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    2.2180    2.5326    0.0000 S   0  0  0  0  0  0  0  0  0  0  0  0
    1.3951    1.4000    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    2.2180    0.2674    0.0000 N   0  0  0  0  0  0  0  0  0  0  0  0
    0.0000    1.4000    0.0000 N   0  0  0  0  0  0  0  0  0  0  0  0
    7.1826    2.7976    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
    8.3908    2.1000    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    9.0908    3.3124    0.0000 F   0  0  0  0  0  0  0  0  0  0  0  0
    9.6033    1.4000    0.0000 F   0  0  0  0  0  0  0  0  0  0  0  0
    7.6908    0.8876    0.0000 F   0  0  0  0  0  0  0  0  0  0  0  0
  1  2  2  0  0  0  0
  2  3  1  0  0  0  0
  3  4  2  0  0  0  0
  4  5  1  0  0  0  0
  5  6  2  0  0  0  0
  6  1  1  0  0  0  0
  1  7  1  0  0  0  0
  7  8  1  0  0  0  0
  8  9  2  0  0  0  0
  9  2  1  0  0  0  0
  8 10  1  0  0  0  0
  5 11  1  0  0  0  0
 11 12  1  0  0  0  0
 12 13  1  0  0  0  0
 12 14  1  0  0  0  0
 12 15  1  0  0  0  0
M  END
>  <Mol_ID> (7)
446

>  <Formula> (7)
C8H5F3N2OS

>  <MolWeight> (7)
234.1983096

>  <Item Name> (7)
Riluzole (Rilutek)

>  <Catalog Number> (7)
S1614

>  <Synonyms> (7)
PK-26124, RP-54274, Rilutek

>  <Target> (7)
Sodium Channel

>  <Form> (7)
Free Base

>  <URL> (7)
http://www.selleckchem.com/products/Riluzole(Rilutek).html

>  <CAS Number> (7)
1744-22-5

$$$$
DYNACIRC (isradipine).cdx
csChFnd80/10101813122D

 27 29  0  0  0  0  0  0  0  0999 V2000
    2.4165    7.3889    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    2.4165    5.9889    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    3.6289    5.2889    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    4.8413    5.9889    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    4.8413    7.3889    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    3.6289    8.0889    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    6.1728    5.5563    0.0000 N   0  0  0  0  0  0  0  0  0  0  0  0
    6.9957    6.6889    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
    6.1728    7.8215    0.0000 N   0  0  0  0  0  0  0  0  0  0  0  0
    3.6289    2.8000    0.0000 C   0  0  3  0  0  0  0  0  0  0  0  0
    2.4165    2.1000    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    2.4165    0.7000    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    3.6289    0.0000    0.0000 N   0  0  0  0  0  0  0  0  0  0  0  0
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    4.8413    2.1000    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    1.2082    2.7976    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    0.0000    2.1000    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
    1.2082    4.1927    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
    0.0000    4.8903    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
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    6.0496    0.0024    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    6.0496    2.7976    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    7.2578    2.1000    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
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    9.6742    2.1000    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    8.4660    4.1927    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    6.0496    4.1927    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
  1  2  1  0  0  0  0
  2  3  2  0  0  0  0
  3  4  1  0  0  0  0
  4  5  1  0  0  0  0
  5  6  1  0  0  0  0
  6  1  2  0  0  0  0
  4  7  2  0  0  0  0
  7  8  1  0  0  0  0
  8  9  1  0  0  0  0
  9  5  2  0  0  0  0
 10 11  1  0  0  0  0
 11 12  2  0  0  0  0
 12 13  1  0  0  0  0
 13 14  1  0  0  0  0
 14 15  2  0  0  0  0
 15 10  1  0  0  0  0
 11 16  1  0  0  0  0
 16 17  2  0  0  0  0
 16 18  1  0  0  0  0
 18 19  1  0  0  0  0
 12 20  1  0  0  0  0
 14 21  1  0  0  0  0
 15 22  1  0  0  0  0
 22 23  1  0  0  0  0
 23 24  1  0  0  0  0
 24 25  1  0  0  0  0
 24 26  1  0  0  0  0
 22 27  2  0  0  0  0
  3 10  1  0  0  0  0
M  END
>  <Mol_ID> (8)
483

>  <Formula> (8)
C19H21N3O5

>  <MolWeight> (8)
371.38714

>  <Item Name> (8)
Isradipine (Dynacirc)

>  <Catalog Number> (8)
S1662

>  <Synonyms> (8)
DynaCirc, Prescal, PN-200-110, Clivoten, Esradin 

>  <Target> (8)
Calcium Channel

>  <Form> (8)
Free Base

>  <URL> (8)
http://www.selleckchem.com/products/Isradipine(Dynacirc).html

>  <CAS Number> (8)
75695-93-1

$$$$
CARBAMAZEPINE (carbamazepine).cdx
csChFnd80/10101813122D

 18 20  0  0  0  0  0  0  0  0999 V2000
    3.9370    2.0976    0.0000 N   0  0  0  0  0  0  0  0  0  0  0  0
    3.9370    0.6976    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    5.1983    2.7050    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    5.5098    4.0699    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    4.6370    5.1645    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    3.2370    5.1645    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    2.3641    4.0699    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    2.6756    2.7050    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    1.0263    4.4826    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    0.0000    3.5303    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    0.3115    2.1654    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    1.6493    1.7528    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    6.2246    1.7528    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    7.5624    2.1654    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    7.8739    3.5303    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    6.8476    4.4826    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    2.7287    0.0000    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
    5.1452    0.0000    0.0000 N   0  0  0  0  0  0  0  0  0  0  0  0
  1  2  1  0  0  0  0
  1  3  1  0  0  0  0
  3  4  2  0  0  0  0
  4  5  1  0  0  0  0
  5  6  2  0  0  0  0
  6  7  1  0  0  0  0
  7  8  2  0  0  0  0
  8  1  1  0  0  0  0
  7  9  1  0  0  0  0
  9 10  2  0  0  0  0
 10 11  1  0  0  0  0
 11 12  2  0  0  0  0
 12  8  1  0  0  0  0
  3 13  1  0  0  0  0
 13 14  2  0  0  0  0
 14 15  1  0  0  0  0
 15 16  2  0  0  0  0
 16  4  1  0  0  0  0
  2 17  2  0  0  0  0
  2 18  1  0  0  0  0
M  END
>  <Mol_ID> (9)
501

>  <Formula> (9)
C15H12N2O

>  <MolWeight> (9)
236.26858

>  <Item Name> (9)
Carbamazepine (Carbatrol)

>  <Catalog Number> (9)
S1693

>  <Synonyms> (9)
Equetro, Tegretol, Biston 

>  <Target> (9)
Autophagy,Sodium Channel

>  <Form> (9)
Free Base

>  <URL> (9)
http://www.selleckchem.com/products/Carbamazepine(Carbatrol).html

>  <CAS Number> (9)
298-46-4

$$$$
NIMOTOP (nimodipine).cdx
csChFnd80/10101813122D

 30 31  0  0  0  0  0  0  0  0999 V2000
    4.8497    7.7146    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    4.8497    6.3098    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    6.0664    5.6073    0.0000 C   0  0  3  0  0  0  0  0  0  0  0  0
    7.2831    6.3098    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    7.2831    7.7146    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    6.0664    8.4171    0.0000 N   0  0  0  0  0  0  0  0  0  0  0  0
    6.0664    4.2073    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    4.8497    3.5049    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    4.8497    2.1000    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    6.0664    1.3976    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    7.2831    2.1000    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    7.2831    3.5049    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    8.4955    1.4000    0.0000 N   0  3  0  0  0  0  0  0  0  0  0  0
    8.4955    0.0000    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
    9.7079    2.1000    0.0000 O   0  5  0  0  0  0  0  0  0  0  0  0
    8.4955    8.4146    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    3.6373    8.4146    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    8.4955    5.6098    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    9.7079    6.3098    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
   10.9204    5.6098    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   12.1328    6.3098    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   13.3452    5.6098    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
   14.5577    6.3098    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    8.4955    4.2098    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
    3.6373    5.6098    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    2.4249    6.3098    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
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>  <Mol_ID> (10)
533

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C21H26N2O7

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418.44034

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Nimodipine (Nimotop)

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S1747

>  <Synonyms> (10)
Nimotop

>  <Target> (10)
Autophagy,Calcium Channel

>  <Form> (10)
Free Base

>  <URL> (10)
http://www.selleckchem.com/products/Nimodipine(Nimotop).html

>  <CAS Number> (10)
66085-59-4

$$$$
Nefiracetam.cdx
csChFnd80/10101813122D

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582

>  <Formula> (11)
C14H18N2O2

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Nefiracetam (Translon)

>  <Catalog Number> (11)
S1969

>  <Synonyms> (11)
DM 9384, Translon, DZL-221

>  <Target> (11)
GABA Receptor

>  <Form> (11)
Free Base

>  <URL> (11)
http://www.selleckchem.com/products/Nefiracetam(Translon).html

>  <CAS Number> (11)
77191-36-7

$$$$
Nicorandil.cdx
csChFnd80/10101813122D

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>  <Mol_ID> (12)
583

>  <Formula> (12)
C8H9N3O4

>  <MolWeight> (12)
211.17476

>  <Item Name> (12)
Nicorandil (Ikorel)

>  <Catalog Number> (12)
S1971

>  <Synonyms> (12)
SG-75

>  <Target> (12)
Potassium Channel

>  <Form> (12)
Free Base

>  <URL> (12)
http://www.selleckchem.com/products/Nicorandil(Ikorel).html

>  <CAS Number> (12)
65141-46-0

$$$$
PF 3716556.cdx
csChFnd80/10101813122D

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>  <Mol_ID> (13)
585

>  <Formula> (13)
C22H26N4O3

>  <MolWeight> (13)
394.46684

>  <Item Name> (13)
PF 3716556

>  <Catalog Number> (13)
S2222

>  <Synonyms> (13)
N/A 

>  <Target> (13)
ATPase, Proton Pump

>  <Form> (13)
Free Base

>  <URL> (13)
http://www.selleckchem.com/products/PF-3716556.html

>  <CAS Number> (13)
928774-43-0

$$$$
AMLODIPINE (amlodipine).cdx
csChFnd80/10101813122D

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>  <Mol_ID> (14)
737

>  <Formula> (14)
C20H25ClN2O5

>  <MolWeight> (14)
408.8759

>  <Item Name> (14)
Amlodipine (Norvasc)

>  <Catalog Number> (14)
S1905

>  <Synonyms> (14)
Istin, Norvasc, Caduet

>  <Target> (14)
Calcium Channel

>  <Form> (14)
Free Base

>  <URL> (14)
http://www.selleckchem.com/products/Amlodipine(Norvasc).html

>  <CAS Number> (14)
88150-42-9

$$$$
Tolbutamide.cdx
csChFnd80/10101813122D

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>  <Mol_ID> (15)
756

>  <Formula> (15)
C12H18N2O3S

>  <MolWeight> (15)
270.34792

>  <Item Name> (15)
Tolbutamide

>  <Catalog Number> (15)
S2443 

>  <Synonyms> (15)
N/A 

>  <Target> (15)
Potassium Channel 

>  <Form> (15)
Free Base

>  <URL> (15)
http://www.selleckchem.com/products/tolbutamide.html

>  <CAS Number> (15)
64-77-7

$$$$
Chlorpromazine HCl.cdx
csChFnd80/10101813122D

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M  END
>  <Mol_ID> (16)
809

>  <Formula> (16)
C17H20Cl2N2S

>  <MolWeight> (16)
355.3251

>  <Item Name> (16)
Chlorpromazine HCl

>  <Catalog Number> (16)
S2456

>  <Synonyms> (16)
Sonazine

>  <Target> (16)
Dopamine Receptor, Potassium Channel

>  <Form> (16)
Hydrochloride

>  <URL> (16)
http://www.selleckchem.com/products/Chlorpromazine-hydrochloride(Sonazine).html

>  <CAS Number> (16)
69-09-0

$$$$
Manidipine.cdx
csChFnd80/10101813122D

 45 49  0  0  0  0  0  0  0  0999 V2000
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M  END
>  <Mol_ID> (17)
826

>  <Formula> (17)
C35H38N4O6

>  <MolWeight> (17)
610.69942

>  <Item Name> (17)
Manidipine (Manyper)

>  <Catalog Number> (17)
S2481

>  <Synonyms> (17)
Artedil, Iperten 

>  <Target> (17)
Calcium Channel

>  <Form> (17)
Free Base

>  <URL> (17)
http://www.selleckchem.com/products/Manidipine(Manyper).html

>  <CAS Number> (17)
89226-50-6

$$$$
nateglinide.cdx
csChFnd80/10101813122D

 23 24  0  0  0  0  0  0  0  0999 V2000
   10.8909    2.7976    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
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M  END
>  <Mol_ID> (18)
841

>  <Formula> (18)
C19H27NO3

>  <MolWeight> (18)
317.42258

>  <Item Name> (18)
Nateglinide (Starlix)

>  <Catalog Number> (18)
S2489

>  <Synonyms> (18)
Starlix

>  <Target> (18)
Potassium Channel

>  <Form> (18)
Free Base

>  <URL> (18)
http://www.selleckchem.com/products/Nateglinide(Starlix).html

>  <CAS Number> (18)
105816-04-4

$$$$
Nitrendipine.cdx
csChFnd80/10101813122D

 26 27  0  0  0  0  0  0  0  0999 V2000
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M  END
>  <Mol_ID> (19)
844

>  <Formula> (19)
C18H20N2O6

>  <MolWeight> (19)
360.3612

>  <Item Name> (19)
Nitrendipine

>  <Catalog Number> (19)
S2491

>  <Synonyms> (19)
N/A

>  <Target> (19)
Calcium Channel

>  <Form> (19)
Free Base

>  <URL> (19)
http://www.selleckchem.com/products/Nitrendipine.html

>  <CAS Number> (19)
39562-70-4

$$$$
Phenytoin sodium.cdx
csChFnd80/10101813122D

 20 21  0  0  0  0  0  0  0  0999 V2000
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    2.4249    5.4322    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    1.2124    6.1322    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    0.0000    5.4322    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    0.0000    4.0322    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    1.2124    3.3322    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
  1  2  1  0  0  0  0
  2  3  1  0  0  0  0
  3  4  1  0  0  0  0
  4  5  2  0  0  0  0
  5  1  1  0  0  0  0
  5  6  1  0  0  0  0
  3  8  2  0  0  0  0
  2  9  1  0  0  0  0
  2 10  1  0  0  0  0
 10 11  2  0  0  0  0
 11 12  1  0  0  0  0
 12 13  2  0  0  0  0
 13 14  1  0  0  0  0
 14 15  2  0  0  0  0
 15 10  1  0  0  0  0
  9 16  2  0  0  0  0
 16 17  1  0  0  0  0
 17 18  2  0  0  0  0
 18 19  1  0  0  0  0
 19 20  2  0  0  0  0
 20  9  1  0  0  0  0
M  END
>  <Mol_ID> (20)
867

>  <Formula> (20)
C15H11N2NaO2

>  <MolWeight> (20)
274.24981

>  <Item Name> (20)
Phenytoin sodium (Dilantin)

>  <Catalog Number> (20)
S2524

>  <Synonyms> (20)
Aleviatin, Diphenylhydantoin sodium, Eptoin, Phenytoin soluble, Prompt; Phenytek 

>  <Target> (20)
Sodium Channel

>  <Form> (20)
Sodium Salt

>  <URL> (20)
http://www.selleckchem.com/products/Phenytoin-sodium-Dilantin.html

>  <CAS Number> (20)
630-93-3

$$$$
Ketanserin.cdx
csChFnd80/10101813122D

 29 32  0  0  0  0  0  0  0  0999 V2000
    0.0000    2.1000    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    0.0000    0.7000    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    1.2124    0.0000    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    2.4249    0.7000    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    2.4249    2.1000    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    1.2124    2.8000    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    3.6373    0.0000    0.0000 N   0  0  0  0  0  0  0  0  0  0  0  0
    4.8497    0.7000    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    4.8497    2.1000    0.0000 N   0  0  0  0  0  0  0  0  0  0  0  0
    3.6373    2.8000    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    3.6373    4.1951    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
    6.0580    0.0024    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
    6.0580    2.7976    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    7.2704    2.0976    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    8.4786    2.7951    0.0000 N   0  0  0  0  0  0  0  0  0  0  0  0
    9.6911    2.0951    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   10.9035    2.7951    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   10.9035    4.1951    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    9.6911    4.8951    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    8.4786    4.1951    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   12.1117    4.8927    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   13.3200    4.1951    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   12.1117    6.2879    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
   13.3200    2.7951    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   14.5324    2.0951    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   15.7448    2.7951    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   15.7448    4.1951    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   14.5324    4.8951    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   16.9531    2.0976    0.0000 F   0  0  0  0  0  0  0  0  0  0  0  0
  1  2  2  0  0  0  0
  2  3  1  0  0  0  0
  3  4  2  0  0  0  0
  4  5  1  0  0  0  0
  5  6  2  0  0  0  0
  6  1  1  0  0  0  0
  4  7  1  0  0  0  0
  7  8  1  0  0  0  0
  8  9  1  0  0  0  0
  9 10  1  0  0  0  0
 10  5  1  0  0  0  0
 10 11  2  0  0  0  0
  8 12  2  0  0  0  0
  9 13  1  0  0  0  0
 13 14  1  0  0  0  0
 14 15  1  0  0  0  0
 15 16  1  0  0  0  0
 16 17  1  0  0  0  0
 17 18  1  0  0  0  0
 18 19  1  0  0  0  0
 19 20  1  0  0  0  0
 20 15  1  0  0  0  0
 18 21  1  0  0  0  0
 21 22  1  0  0  0  0
 21 23  2  0  0  0  0
 22 24  2  0  0  0  0
 24 25  1  0  0  0  0
 25 26  2  0  0  0  0
 26 27  1  0  0  0  0
 27 28  2  0  0  0  0
 28 22  1  0  0  0  0
 26 29  1  0  0  0  0
M  END
>  <Mol_ID> (21)
892

>  <Formula> (21)
C22H22FN3O3

>  <MolWeight> (21)
395.4267832

>  <Item Name> (21)
Ketanserin (Vulketan Gel)

>  <Catalog Number> (21)
S2232

>  <Synonyms> (21)
R 41468, Vulketan Gel

>  <Target> (21)
5-HT Receptor

>  <Form> (21)
Free Base

>  <URL> (21)
http://www.selleckchem.com/products/Ketanserin-Vulketan-Gel.html

>  <CAS Number> (21)
74050-98-9

$$$$
Ginkgolide A.cdx
csChFnd80/10101813122D

 31 36  0  0  0  0  0  0  0  0999 V2000
    0.0000    3.5918    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
    1.4000    3.5918    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    2.2229    2.4591    0.0000 C   0  0  2  0  0  0  0  0  0  0  0  0
    3.5544    2.8918    0.0000 C   0  0  1  0  0  0  0  0  0  0  0  0
    3.5544    4.2918    0.0000 C   0  0  1  0  0  0  0  0  0  0  0  0
    2.2229    4.7244    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
    4.8859    2.4591    0.0000 C   0  0  2  0  0  0  0  0  0  0  0  0
    5.7088    3.5918    0.0000 C   0  0  3  0  0  0  0  0  0  0  0  0
    4.8859    4.7244    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    6.5317    2.4591    0.0000 C   0  0  1  0  0  0  0  0  0  0  0  0
    7.8631    2.8918    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    7.8631    4.2918    0.0000 C   0  0  2  0  0  0  0  0  0  0  0  0
    6.5317    4.7244    0.0000 C   0  0  3  0  0  0  0  0  0  0  0  0
    5.2482    1.1068    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    6.1693    1.1068    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
    4.3989    0.0000    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
    3.5544    1.4966    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
    3.5544    5.6869    0.0000 H   0  0  0  0  0  0  0  0  0  0  0  0
    2.2229    1.0591    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    7.5216    1.4692    0.0000 H   0  0  0  0  0  0  0  0  0  0  0  0
    8.9918    5.1118    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    8.8460    6.4993    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   10.2664    4.5443    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   10.1205    5.9318    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    7.8840    5.0867    0.0000 C   0  0  1  0  0  0  0  0  0  0  0  0
    7.9572    6.4848    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
    6.6502    6.9865    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    5.7692    5.8985    0.0000 C   0  0  2  0  0  0  0  0  0  0  0  0
    6.2891    8.3341    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
    6.7813    3.8105    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
    4.7792    6.8885    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
  1  2  2  0  0  0  0
  2  3  1  0  0  0  0
  3  4  1  0  0  0  0
  4  5  1  0  0  0  0
  5  6  1  0  0  0  0
  6  2  1  0  0  0  0
  4  7  1  0  0  0  0
  7  8  1  0  0  0  0
  8  9  1  0  0  0  0
  9  5  1  0  0  0  0
  8 10  1  0  0  0  0
 10 11  1  0  0  0  0
 11 12  1  0  0  0  0
 12 13  1  0  0  0  0
 13  8  1  0  0  0  0
  7 14  1  6  0  0  0
 10 15  1  0  0  0  0
 14 15  1  0  0  0  0
 14 16  2  0  0  0  0
  4 17  1  6  0  0  0
  5 18  1  6  0  0  0
  3 19  1  6  0  0  0
 10 20  1  6  0  0  0
 12 21  1  6  0  0  0
 21 22  1  0  0  0  0
 21 23  1  0  0  0  0
 21 24  1  0  0  0  0
 13 25  1  0  0  0  0
 25 26  1  0  0  0  0
 26 27  1  0  0  0  0
 27 28  1  0  0  0  0
 28 13  1  0  0  0  0
 27 29  2  0  0  0  0
 25 30  1  1  0  0  0
  7 30  1  0  0  0  0
 28 31  1  1  0  0  0
M  END
>  <Mol_ID> (22)
967

>  <Formula> (22)
C20H24O9

>  <MolWeight> (22)
408.39916

>  <Item Name> (22)
Ginkgolide A

>  <Catalog Number> (22)
S2026

>  <Synonyms> (22)
BN52020

>  <Target> (22)
GABA Receptor

>  <Form> (22)
Free Base

>  <URL> (22)
http://www.selleckchem.com/products/ginkgolide-a.html

>  <CAS Number> (22)
15291-75-5

$$$$
Amiloride hydrochloride dihydrate.cdx
csChFnd80/10101813122D

 18 15  0  0  0  0  0  0  0  0999 V2000
    1.2124    4.6537    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    1.2124    3.2488    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    2.4291    2.5463    0.0000 N   0  0  0  0  0  0  0  0  0  0  0  0
    3.6458    3.2488    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    3.6458    4.6537    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    2.4291    5.3561    0.0000 N   0  0  0  0  0  0  0  0  0  0  0  0
    0.0000    5.3537    0.0000 Cl  0  0  0  0  0  0  0  0  0  0  0  0
    0.0000    2.5488    0.0000 N   0  0  0  0  0  0  0  0  0  0  0  0
    4.8582    2.5488    0.0000 N   0  0  0  0  0  0  0  0  0  0  0  0
    4.8582    5.3537    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    6.0706    4.6537    0.0000 N   0  0  0  0  0  0  0  0  0  0  0  0
    4.8582    6.7537    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
    7.2831    5.3537    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
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    1.4047    0.0000    0.0000 Cl  0  0  0  0  0  0  0  0  0  0  0  0
    4.9478    3.3769    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
    3.5478    3.3769    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
  1  2  2  0  0  0  0
  2  3  1  0  0  0  0
  3  4  2  0  0  0  0
  4  5  1  0  0  0  0
  5  6  2  0  0  0  0
  6  1  1  0  0  0  0
  1  7  1  0  0  0  0
  2  8  1  0  0  0  0
  4  9  1  0  0  0  0
  5 10  1  0  0  0  0
 10 11  1  0  0  0  0
 10 12  2  0  0  0  0
 11 13  1  0  0  0  0
 13 14  1  0  0  0  0
 13 15  2  0  0  0  0
M  END
>  <Mol_ID> (23)
1004

>  <Formula> (23)
C6H13Cl2N7O3

>  <MolWeight> (23)
302.11852

>  <Item Name> (23)
Amiloride hydrochloride dihydrate

>  <Catalog Number> (23)
S2560 

>  <Synonyms> (23)
MK-870

>  <Target> (23)
Sodium Channel

>  <Form> (23)
hydrochloride & dihydrate

>  <URL> (23)
http://www.selleckchem.com/products/amilorida.html

>  <CAS Number> (23)
17440-83-4

$$$$
Benidipine hydrochloride.cdx
csChFnd80/10101813122D

 38 40  0  0  0  0  0  0  0  0999 V2000
   12.1033    5.7458    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   12.1033    4.3458    0.0000 C   0  0  1  0  0  0  0  0  0  0  0  0
   10.8909    3.6458    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   10.8909    2.2458    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   12.1033    1.5458    0.0000 N   0  0  0  0  0  0  0  0  0  0  0  0
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   10.8909    7.8458    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   10.8909    6.4458    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   14.5240    1.5483    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
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 29 30  2  0  0  0  0
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 25 26  2  0  0  0  0
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M  END
>  <Mol_ID> (24)
1034

>  <Formula> (24)
C28H32ClN3O6

>  <MolWeight> (24)
542.02318

>  <Item Name> (24)
Benidipine hydrochloride

>  <Catalog Number> (24)
S2017

>  <Synonyms> (24)
N/A

>  <Target> (24)
calcium channel

>  <Form> (24)
Hydrochloride

>  <URL> (24)
http://www.selleckchem.com/products/benidipine-hydrochloride.html

>  <CAS Number> (24)
91599-74-5

$$$$
Lacidipine.cdx
csChFnd80/10101813122D

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M  END
>  <Mol_ID> (25)
1040

>  <Formula> (25)
C26H33NO6

>  <MolWeight> (25)
455.54332

>  <Item Name> (25)
Lacidipine (Lacipil, Motens)

>  <Catalog Number> (25)
S1994

>  <Synonyms> (25)
Lacipil, Motens

>  <Target> (25)
Calcium Channel 

>  <Form> (25)
Free Base

>  <URL> (25)
http://www.selleckchem.com/products/lacidipine-lacipil-motens.html

>  <CAS Number> (25)
103890-78-4

$$$$
Tetracaine hydrochloride.cdx
csChFnd80/10101813122D

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M  END
>  <Mol_ID> (26)
1048

>  <Formula> (26)
C15H25ClN2O2

>  <MolWeight> (26)
300.8242

>  <Item Name> (26)
Tetracaine hydrochloride (Pontocaine)

>  <Catalog Number> (26)
S2573 

>  <Synonyms> (26)
N/A 

>  <Target> (26)
Calcium Channel

>  <Form> (26)
Hydrochloride 

>  <URL> (26)
http://www.selleckchem.com/products/tetracaine-hydrochloride-pontocaine.html

>  <CAS Number> (26)
136-47-0

$$$$
Gliclazide.cdx
csChFnd80/10101813122D

 22 24  0  0  0  0  0  0  0  0999 V2000
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M  END
>  <Mol_ID> (27)
1093

>  <Formula> (27)
C15H21N3O3S

>  <MolWeight> (27)
323.41054

>  <Item Name> (27)
Gliclazide (Diamicron)

>  <Catalog Number> (27)
S2601 

>  <Synonyms> (27)
N/A 

>  <Target> (27)
Potassium Channel

>  <Form> (27)
Free Base

>  <URL> (27)
http://www.selleckchem.com/products/gliclazide-diamicron.html

>  <CAS Number> (27)
21187-98-4

$$$$
Amiodarone hydrochloride.cdx
csChFnd80/10101813122D

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M  END
>  <Mol_ID> (28)
1143

>  <Formula> (28)
C25H30ClI2NO3

>  <MolWeight> (28)
681.77254

>  <Item Name> (28)
Amiodarone HCl

>  <Catalog Number> (28)
S1979 

>  <Synonyms> (28)
N/A

>  <Target> (28)
Potassium Channel

>  <Form> (28)
Hydrochloride

>  <URL> (28)
http://www.selleckchem.com/products/amiodarone-hcl.html

>  <CAS Number> (28)
19774-82-4

$$$$
A-803467.cdx
csChFnd80/10101813122D

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>  <Mol_ID> (29)
1174

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C19H16ClNO4

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A-803467

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S2785 

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Sodium Channel 

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Free Base

>  <URL> (29)
http://www.selleckchem.com/products/a-803467.html

>  <CAS Number> (29)
944261-79-4

$$$$
Lamotrigine.cdx
csChFnd80/10101813122D

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>  <Mol_ID> (30)
1189

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C9H7Cl2N5

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256.09138

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Lamotrigine

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S3024 

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N/A 

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Sodium Channel 

>  <Form> (30)
Free Base

>  <URL> (30)
http://www.selleckchem.com/products/lamotrigine.html

>  <CAS Number> (30)
84057-84-1

$$$$
ML133 HCL.cdx
csChFnd80/10101813122D

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>  <Mol_ID> (31)
1221

>  <Formula> (31)
C19H20ClNO

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ML133 HCL

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S2825

>  <Synonyms> (31)
N/A 

>  <Target> (31)
Potassium Channel

>  <Form> (31)
Hydrochloride

>  <URL> (31)
http://www.selleckchem.com/products/Ml-133-hcl.html

>  <CAS Number> (31)
1222781-70-5

$$$$
Rufinamide.cdx
csChFnd80/10101813122D

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>  <Mol_ID> (32)
1232

>  <Formula> (32)
C10H8F2N4O

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Rufinamide (Banzel)

>  <Catalog Number> (32)
S1256

>  <Synonyms> (32)
Banzel 

>  <Target> (32)
Sodium Channel

>  <Form> (32)
Free Base

>  <URL> (32)
http://www.selleckchem.com/products/Rufinamide.html

>  <CAS Number> (32)
106308-44-5

$$$$
Gliquidone.cdx
csChFnd80/10101813122D

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>  <Mol_ID> (33)
1251

>  <Formula> (33)
C27H33N3O6S

>  <MolWeight> (33)
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>  <Item Name> (33)
Gliquidone

>  <Catalog Number> (33)
S3151

>  <Synonyms> (33)
Glurenorm 

>  <Target> (33)
Potassium Channel

>  <Form> (33)
Free Base

>  <URL> (33)
http://www.selleckchem.com/products/gliquidone.html

>  <CAS Number> (33)
33342-05-1

$$$$
Azelnidipine.cdx
csChFnd80/10101813122D

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M  END
>  <Mol_ID> (34)
1309

>  <Formula> (34)
C33H34N4O6

>  <MolWeight> (34)
582.64626

>  <Item Name> (34)
Azelnidipine

>  <Catalog Number> (34)
S3053

>  <Synonyms> (34)
N/A

>  <Target> (34)
Calcium Channel

>  <Form> (34)
Free Base

>  <URL> (34)
http://www.selleckchem.com/products/azelnidipine.html

>  <CAS Number> (34)
123524-52-7

$$$$
Gambogic acid.cdx
csChFnd80/10101813122D

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M  END
>  <Mol_ID> (35)
1332

>  <Formula> (35)
C38H44O8

>  <MolWeight> (35)
628.75116

>  <Item Name> (35)
Gambogic Acid

>  <Catalog Number> (35)
S2448

>  <Synonyms> (35)
N/A

>  <Target> (35)
Bcl-2,Caspase

>  <Form> (35)
Free Base

>  <URL> (35)
http://www.selleckchem.com/products/gambogic-acid.html

>  <CAS Number> (35)
2752-65-0

$$$$
Oxcarbazepine.cdx
csChFnd80/10101813122D

 19 21  0  0  0  0  0  0  0  0999 V2000
    3.2370    2.4097    0.0000 N   0  0  0  0  0  0  0  0  0  0  0  0
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    3.9370    5.4766    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
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    2.3641    3.5043    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    1.6493    5.8214    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
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 11  7  1  0  0  0  0
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 17 19  2  0  0  0  0
M  END
>  <Mol_ID> (36)
1407

>  <Formula> (36)
C15H12N2O2

>  <MolWeight> (36)
252.26798

>  <Item Name> (36)
Oxcarbazepine

>  <Catalog Number> (36)
S1391

>  <Synonyms> (36)
Trileptal

>  <Target> (36)
Sodium Channel

>  <Form> (36)
Free Base

>  <URL> (36)
http://www.selleckchem.com/products/Oxcarbazepine.html

>  <CAS Number> (36)
28721-07-5

$$$$
Flunarizine dihydrochloride.cdx
csChFnd80/10101813122D

 32 33  0  0  0  0  0  0  0  0999 V2000
   10.1504    7.6879    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
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  6  1  1  0  0  0  0
  4  7  1  0  0  0  0
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  7  9  1  0  0  0  0
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 13 14  2  0  0  0  0
 14  9  1  0  0  0  0
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 15 16  1  0  0  0  0
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 19  8  1  0  0  0  0
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 29 30  2  0  0  0  0
 30 23  1  0  0  0  0
M  END
>  <Mol_ID> (37)
1438

>  <Formula> (37)
C26H28Cl2F2N2

>  <MolWeight> (37)
477.4167264

>  <Item Name> (37)
Flunarizine 2HCl

>  <Catalog Number> (37)
S2030

>  <Synonyms> (37)
N/A

>  <Target> (37)
Calcium Channel

>  <Form> (37)
2HCl

>  <URL> (37)
http://www.selleckchem.com/products/flunarizine-dihydrochloride.html

>  <CAS Number> (37)
30484-77-6

$$$$
Cleviprex.cdx
csChFnd80/10101813122D

 30 31  0  0  0  0  0  0  0  0999 V2000
    0.0000    2.0976    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
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    2.4207    2.1000    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
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M  END
>  <Mol_ID> (38)
1455

>  <Formula> (38)
C21H23Cl2NO6

>  <MolWeight> (38)
456.31642

>  <Item Name> (38)
Clevidipine Butyrate

>  <Catalog Number> (38)
S2080

>  <Synonyms> (38)
N/A

>  <Target> (38)
Calcium Channel

>  <Form> (38)
Free Base

>  <URL> (38)
http://www.selleckchem.com/products/cleviprex-clevidipine.html

>  <CAS Number> (38)
167221-71-8

$$$$
Vinpocetine.cdx
csChFnd80/10101813122D

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M  END
>  <Mol_ID> (39)
1470

>  <Formula> (39)
C22H26N2O2

>  <MolWeight> (39)
350.45404

>  <Item Name> (39)
Vinpocetine (Cavinton)

>  <Catalog Number> (39)
S2110

>  <Synonyms> (39)
N/A

>  <Target> (39)
Sodium Channel

>  <Form> (39)
Free Base

>  <URL> (39)
http://www.selleckchem.com/products/vinpocetine-cavinton.html

>  <CAS Number> (39)
42971-09-5

$$$$

csChFnd80/10101813122D

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M  END
>  <Mol_ID> (40)
1473

>  <Formula> (40)
C44H76N4O10S2

>  <MolWeight> (40)
885.22504

>  <Item Name> (40)
Ibutilide fumarate

>  <Catalog Number> (40)
S2118

>  <Synonyms> (40)
N/A

>  <Target> (40)
Sodium Channel

>  <Form> (40)
Fumarate

>  <URL> (40)
http://www.selleckchem.com/products/ibutilide-fumarate.html

>  <CAS Number> (40)
122647-32-9

$$$$
Propafenone.cdx
csChFnd80/10101813122D

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 17 18  1  0  0  0  0
 18 19  1  0  0  0  0
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 22 23  1  0  0  0  0
 23 24  1  0  0  0  0
 24 25  1  0  0  0  0
M  END
>  <Mol_ID> (41)
1482

>  <Formula> (41)
C21H27NO3

>  <MolWeight> (41)
341.44398

>  <Item Name> (41)
Propafenone HCl

>  <Catalog Number> (41)
S2500

>  <Synonyms> (41)
Rythmol SR, Rytmonorm

>  <Target> (41)
Sodium Channel

>  <Form> (41)
Hydrochloride

>  <URL> (41)
http://www.selleckchem.com/products/Propafenone(Rytmonorm).html

>  <CAS Number> (41)
34183-22-7

$$$$
ARC029(Nilvadipine).cdx
csChFnd80/10101813122D

 28 29  0  0  0  0  0  0  0  0999 V2000
    1.2124    4.9073    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    1.2124    3.5024    0.0000 N   0  0  0  0  0  0  0  0  0  0  0  0
    2.4291    2.8000    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    3.6458    3.5024    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    3.6458    4.9073    0.0000 C   0  0  3  0  0  0  0  0  0  0  0  0
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    0.0000    5.6073    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    2.4291    1.4000    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
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    4.8582    5.6073    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
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    3.6415    7.7098    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
    3.6415    9.1097    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    2.4291    9.8097    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    4.8540    9.8097    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
  1  2  1  0  0  0  0
  2  3  1  0  0  0  0
  3  4  2  0  0  0  0
  4  5  1  0  0  0  0
  5  6  1  0  0  0  0
  6  1  2  0  0  0  0
  1  7  1  0  0  0  0
  3  8  1  0  0  0  0
  5 10  1  0  0  0  0
 10 11  2  0  0  0  0
 11 12  1  0  0  0  0
 12 13  2  0  0  0  0
 13 14  1  0  0  0  0
 14 15  2  0  0  0  0
 15 10  1  0  0  0  0
  4 16  1  0  0  0  0
 16 17  1  0  0  0  0
 16 18  2  0  0  0  0
 17 19  1  0  0  0  0
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 23 24  2  0  0  0  0
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 26 28  1  0  0  0  0
  8  9  3  0  0  0  0
 20 21  2  0  0  0  0
 20 22  1  0  0  0  0
M  END
>  <Mol_ID> (42)
1490

>  <Formula> (42)
C19H19N3O6

>  <MolWeight> (42)
385.37066

>  <Item Name> (42)
Nilvadipine (ARC029)

>  <Catalog Number> (42)
S2721

>  <Synonyms> (42)
N/A

>  <Target> (42)
Calcium Channel

>  <Form> (42)
Free Base

>  <URL> (42)
http://www.selleckchem.com/products/nilvadipine-arc029.html

>  <CAS Number> (42)
75530-68-6

$$$$
Niflumic acid.cdx
csChFnd80/10101813122D

 20 21  0  0  0  0  0  0  0  0999 V2000
    3.5000    2.4249    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    2.1000    2.4249    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    1.4000    3.6373    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
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    3.5000    4.8497    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
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    1.4000    1.2124    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
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    5.6000    1.2124    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    6.3000    2.4249    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
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    6.3000    0.0000    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
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    7.1876    4.3373    0.0000 F   0  0  0  0  0  0  0  0  0  0  0  0
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    9.6124    2.9373    0.0000 F   0  0  0  0  0  0  0  0  0  0  0  0
  1  2  1  0  0  0  0
  2  3  2  0  0  0  0
  3  4  1  0  0  0  0
  4  5  2  0  0  0  0
  5  6  1  0  0  0  0
  1  6  2  0  0  0  0
  7  8  2  0  0  0  0
  7  9  1  0  0  0  0
  2  7  1  0  0  0  0
 11 12  1  0  0  0  0
 12 13  2  0  0  0  0
 13 14  1  0  0  0  0
 14 15  2  0  0  0  0
 15 16  1  0  0  0  0
 11 16  2  0  0  0  0
 17 18  1  0  0  0  0
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 17 20  1  0  0  0  0
 13 17  1  0  0  0  0
 10 11  1  0  0  0  0
  1 10  1  0  0  0  0
M  END
>  <Mol_ID> (43)
1498

>  <Formula> (43)
C13H9F3N2O2

>  <MolWeight> (43)
282.2179696

>  <Item Name> (43)
Niflumic acid

>  <Catalog Number> (43)
S3018

>  <Synonyms> (43)
N/A

>  <Target> (43)
GABA Receptor

>  <Form> (43)
Free Base

>  <URL> (43)
http://www.selleckchem.com/products/niflumic-acid.html

>  <CAS Number> (43)
4394-00-7

$$$$
Proparacaine hydrochloride.cdx
csChFnd80/10101813122D

 22 21  0  0  0  0  0  0  0  0999 V2000
    4.8497    3.6146    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    4.8497    2.2098    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    6.0664    1.5073    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    7.2831    2.2098    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    7.2831    3.6146    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
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    0.0000    2.2098    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
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 10 11  1  0  0  0  0
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 17 20  1  0  0  0  0
 20 21  1  0  0  0  0
M  END
>  <Mol_ID> (44)
1503

>  <Formula> (44)
C16H27ClN2O3

>  <MolWeight> (44)
330.85018

>  <Item Name> (44)
Proparacaine HCl

>  <Catalog Number> (44)
S1828

>  <Synonyms> (44)
N/A

>  <Target> (44)
Sodium Channel

>  <Form> (44)
Hydrochloride

>  <URL> (44)
http://www.selleckchem.com/products/proparacaine-hcl.html

>  <CAS Number> (44)
5875-06-9

$$$$
TAK-438.cdx
csChFnd80/10101813122D

 32 33  0  0  0  0  0  0  0  0999 V2000
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   10.0805    1.8897    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
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    4.1497    2.6305    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    4.1612    5.1626    0.0000 S   0  0  0  0  0  0  0  0  0  0  0  0
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   11.2734    4.2817    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
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  5  6  2  0  0  0  0
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 22 23  1  0  0  0  0
 18 23  2  0  0  0  0
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 27 28  1  0  0  0  0
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 28 31  2  0  0  0  0
 28 32  1  0  0  0  0
M  END
>  <Mol_ID> (45)
1535

>  <Formula> (45)
C21H20FN3O6S

>  <MolWeight> (45)
461.4634032

>  <Item Name> (45)
Vonoprazan Fumarate (TAK-438)

>  <Catalog Number> (45)
S8016

>  <Synonyms> (45)
N/A

>  <Target> (45)
Potassium Channel

>  <Form> (45)
Fumarate

>  <URL> (45)
http://www.selleckchem.com/products/tak-438.html

>  <CAS Number> (45)
1260141-27-2

$$$$
procaine hydrochloride.cdx
csChFnd80/10101813122D

 18 17  0  0  0  0  0  0  0  0999 V2000
    3.6372    2.5838    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    4.8498    3.2838    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
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M  END
>  <Mol_ID> (46)
1571

>  <Formula> (46)
C13H21ClN2O2

>  <MolWeight> (46)
272.77104

>  <Item Name> (46)
Procaine (Novocaine) HCl

>  <Catalog Number> (46)
S4023

>  <Synonyms> (46)
N/A

>  <Target> (46)
Sodium Channel

>  <Form> (46)
HCl

>  <URL> (46)
http://www.selleckchem.com/products/procaine-novocaine-hcl.html

>  <CAS Number> (46)
51-05-8

$$$$
Dibucaine HCL.cdx
csChFnd80/10101813122D

 26 26  0  0  0  0  0  0  0  0999 V2000
    2.4324    5.2904    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    3.6486    4.5970    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    2.4248    6.6904    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    1.2238    4.5839    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    4.8572    5.3035    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    3.6562    3.1970    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    3.6335    7.3969    0.0000 N   0  0  0  0  0  0  0  0  0  0  0  0
    1.2086    7.3838    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    0.0076    5.2773    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    4.8497    6.7035    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    4.8724    2.5036    0.0000 N   0  0  0  0  0  0  0  0  0  0  0  0
    2.4476    2.4905    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
    0.0000    6.6773    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    6.0583    7.4101    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
    6.0810    3.2101    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    7.2745    6.7166    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    7.2972    2.5167    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    8.4831    7.4232    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    8.5059    3.2232    0.0000 N   0  0  0  0  0  0  0  0  0  0  0  0
    9.6993    6.7298    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    8.4983    4.6232    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    9.7221    2.5298    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   10.9080    7.4363    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    9.7069    5.3298    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   10.9307    3.2364    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    7.3136    0.0000    0.0000 Cl  0  0  0  0  0  0  0  0  0  0  0  0
  1  2  2  0  0  0  0
  1  3  1  0  0  0  0
  1  4  1  0  0  0  0
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  2  6  1  0  0  0  0
  3  7  2  0  0  0  0
  3  8  1  0  0  0  0
  4  9  2  0  0  0  0
  5 10  2  0  0  0  0
  6 11  1  0  0  0  0
  6 12  2  0  0  0  0
  7 10  1  0  0  0  0
  8 13  2  0  0  0  0
  9 13  1  0  0  0  0
 10 14  1  0  0  0  0
 11 15  1  0  0  0  0
 14 16  1  0  0  0  0
 15 17  1  0  0  0  0
 16 18  1  0  0  0  0
 17 19  1  0  0  0  0
 18 20  1  0  0  0  0
 19 21  1  0  0  0  0
 19 22  1  0  0  0  0
 20 23  1  0  0  0  0
 21 24  1  0  0  0  0
 22 25  1  0  0  0  0
M  END
>  <Mol_ID> (47)
1606

>  <Formula> (47)
C20H30ClN3O2

>  <MolWeight> (47)
379.9241

>  <Item Name> (47)
Dibucaine (Cinchocaine) HCl

>  <Catalog Number> (47)
S4038

>  <Synonyms> (47)
N/A

>  <Target> (47)
Sodium Channel

>  <Form> (47)
hydrochloride

>  <URL> (47)
http://www.selleckchem.com/products/dibucaine-cinchocaine-hcl.html

>  <CAS Number> (47)
61-12-1

$$$$
DYRENIUM (triamterene).cdx
csChFnd80/10101813122D

 19 21  0  0  0  0  0  0  0  0999 V2000
    1.2082    0.7000    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    2.4207    0.0000    0.0000 N   0  0  0  0  0  0  0  0  0  0  0  0
    3.6331    0.7000    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    3.6331    2.1000    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    2.4207    2.8000    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    1.2082    2.1000    0.0000 N   0  0  0  0  0  0  0  0  0  0  0  0
    4.8455    0.0000    0.0000 N   0  0  0  0  0  0  0  0  0  0  0  0
    6.0580    0.7000    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    6.0580    2.1000    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    4.8455    2.8000    0.0000 N   0  0  0  0  0  0  0  0  0  0  0  0
    0.0000    0.0024    0.0000 N   0  0  0  0  0  0  0  0  0  0  0  0
    2.4207    4.1951    0.0000 N   0  0  0  0  0  0  0  0  0  0  0  0
    7.2662    0.0024    0.0000 N   0  0  0  0  0  0  0  0  0  0  0  0
    7.2662    2.7976    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    8.4786    2.0976    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    9.6911    2.7976    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    9.6911    4.1976    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    8.4786    4.8976    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    7.2662    4.1976    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
  1  2  2  0  0  0  0
  2  3  1  0  0  0  0
  3  4  2  0  0  0  0
  4  5  1  0  0  0  0
  5  6  2  0  0  0  0
  6  1  1  0  0  0  0
  3  7  1  0  0  0  0
  7  8  2  0  0  0  0
  8  9  1  0  0  0  0
  9 10  2  0  0  0  0
 10  4  1  0  0  0  0
  1 11  1  0  0  0  0
  5 12  1  0  0  0  0
  8 13  1  0  0  0  0
  9 14  1  0  0  0  0
 14 15  2  0  0  0  0
 15 16  1  0  0  0  0
 16 17  2  0  0  0  0
 17 18  1  0  0  0  0
 18 19  2  0  0  0  0
 19 14  1  0  0  0  0
M  END
>  <Mol_ID> (48)
1644

>  <Formula> (48)
C12H11N7

>  <MolWeight> (48)
253.26264

>  <Item Name> (48)
Triamterene

>  <Catalog Number> (48)
S4080

>  <Synonyms> (48)
N/A

>  <Target> (48)
Sodium Channel

>  <Form> (48)
Free Base

>  <URL> (48)
http://www.selleckchem.com/products/triamterene.html

>  <CAS Number> (48)
396-01-0

$$$$
Nefopam HCl.cdx
csChFnd80/10101813122D

 20 21  0  0  0  0  0  0  0  0999 V2000
    2.4249    3.6789    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    2.4249    2.2789    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    3.4148    1.2889    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    4.8148    1.2889    0.0000 N   0  0  0  0  0  0  0  0  0  0  0  0
    5.8048    2.2789    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    5.8048    3.6789    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    4.8148    4.6688    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
    3.4148    4.6688    0.0000 C   0  0  3  0  0  0  0  0  0  0  0  0
    1.2124    4.3789    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    0.0000    3.6789    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    0.0000    2.2789    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    1.2124    1.5789    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    2.8809    5.9578    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    3.7332    7.0685    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    3.1974    8.3619    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    1.8094    8.5446    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    0.9571    7.4340    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    1.4929    6.1405    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    5.3487    0.0000    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   10.2246    3.6497    0.0000 Cl  0  0  0  0  0  0  0  0  0  0  0  0
  1  2  2  0  0  0  0
  2  3  1  0  0  0  0
  3  4  1  0  0  0  0
  4  5  1  0  0  0  0
  5  6  1  0  0  0  0
  6  7  1  0  0  0  0
  7  8  1  0  0  0  0
  8  1  1  0  0  0  0
  1  9  1  0  0  0  0
  9 10  2  0  0  0  0
 10 11  1  0  0  0  0
 11 12  2  0  0  0  0
 12  2  1  0  0  0  0
  8 13  1  0  0  0  0
 13 14  2  0  0  0  0
 14 15  1  0  0  0  0
 15 16  2  0  0  0  0
 16 17  1  0  0  0  0
 17 18  2  0  0  0  0
 18 13  1  0  0  0  0
  4 19  1  0  0  0  0
M  END
>  <Mol_ID> (49)
1781

>  <Formula> (49)
C17H20ClNO

>  <MolWeight> (49)
289.7998

>  <Item Name> (49)
Nefopam HCl

>  <Catalog Number> (49)
S4180

>  <Synonyms> (49)
N/A

>  <Target> (49)
Others

>  <Form> (49)
Hydrochloride

>  <URL> (49)
http://www.selleckchem.com/products/nefopam-hcl.html

>  <CAS Number> (49)
23327-57-3

$$$$
Thioridazine hydrochloride.cdx
csChFnd80/10101813122D

 26 28  0  0  0  0  0  0  0  0999 V2000
    0.0000    2.1391    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    0.0000    0.7461    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    1.2182    0.0427    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    2.4602    0.7598    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    2.4602    2.1598    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    1.2123    2.8802    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    3.7397    2.8936    0.0000 N   0  0  0  0  0  0  0  0  0  0  0  0
    3.7476    0.0188    0.0000 S   0  0  0  0  0  0  0  0  0  0  0  0
    5.0238    2.1504    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    5.0238    0.7227    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    6.2755    0.0000    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    7.5208    0.7190    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    7.5311    2.1015    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    6.3327    2.9061    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    3.7397    4.2726    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    2.5462    4.9617    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    2.5462    6.3411    0.0000 C   0  0  3  0  0  0  0  0  0  0  0  0
    3.7436    7.0302    0.0000 N   0  0  0  0  0  0  0  0  0  0  0  0
    3.7408    8.4097    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    2.5465    9.0992    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
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    9.9353    2.0925    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
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  1  2  2  0  0  0  0
  2  3  1  0  0  0  0
  3  4  2  0  0  0  0
  4  5  1  0  0  0  0
  5  6  2  0  0  0  0
  6  1  1  0  0  0  0
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  9 10  2  0  0  0  0
 10 11  1  0  0  0  0
 11 12  2  0  0  0  0
 12 13  1  0  0  0  0
 13 14  2  0  0  0  0
 14  9  1  0  0  0  0
  7  9  1  0  0  0  0
  8 10  1  0  0  0  0
  7 15  1  0  0  0  0
 15 16  1  0  0  0  0
 16 17  1  0  0  0  0
 17 18  1  0  0  0  0
 18 19  1  0  0  0  0
 19 20  1  0  0  0  0
 20 21  1  0  0  0  0
 21 22  1  0  0  0  0
 22 17  1  0  0  0  0
 18 23  1  0  0  0  0
 13 24  1  0  0  0  0
 24 25  1  0  0  0  0
M  END
>  <Mol_ID> (50)
2045

>  <Formula> (50)
C21H27ClN2S2

>  <MolWeight> (50)
407.03548

>  <Item Name> (50)
Thioridazine hydrochloride

>  <Catalog Number> (50)
S5563

>  <Synonyms> (50)
Aldazine, Mellaril

>  <Target> (50)
Others

>  <Form> (50)
hydrochloride 

>  <URL> (50)
http://selleckchem.com/products/thioridazine-hydrochloride.html

>  <CAS Number> (50)
130-61-0

$$$$
Lubiprostone.cdx
csChFnd80/10101813122D

 27 27  0  0  0  0  0  0  0  0999 V2000
    1.1326    3.1705    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    1.1326    1.7656    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    2.4687    1.3315    0.0000 C   0  0  2  0  0  0  0  0  0  0  0  0
    3.2945    2.4680    0.0000 C   0  0  1  0  0  0  0  0  0  0  0  0
    2.4687    3.6046    0.0000 C   0  0  1  0  0  0  0  0  0  0  0  0
    2.9014    0.0000    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
    6.7945    1.2556    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    5.3945    1.2556    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    4.6945    2.4680    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    7.4945    2.4680    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    8.8945    2.4680    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    6.1789    2.9469    0.0000 F   0  0  0  0  0  0  0  0  0  0  0  0
    7.7376    3.8468    0.0000 F   0  0  0  0  0  0  0  0  0  0  0  0
    9.5945    3.6805    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   10.9945    3.6805    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   11.6945    4.8929    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    2.9014    4.9361    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    4.2708    5.2272    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    4.7034    6.5587    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    3.7134    7.5486    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    4.0758    8.9009    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
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    0.0000    3.9934    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
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  1  2  1  0  0  0  0
  2  3  1  0  0  0  0
  3  4  1  0  0  0  0
  4  5  1  0  0  0  0
  5  1  1  0  0  0  0
  3  6  1  6  0  0  0
  7  8  1  0  0  0  0
  8  9  1  0  0  0  0
  4  9  1  1  0  0  0
  7 10  1  0  0  0  0
 10 11  1  0  0  0  0
 10 12  1  0  0  0  0
 10 13  1  0  0  0  0
 11 14  1  0  0  0  0
 14 15  1  0  0  0  0
 15 16  1  0  0  0  0
  5 17  1  6  0  0  0
 17 18  1  0  0  0  0
 18 19  1  0  0  0  0
 19 20  1  0  0  0  0
 20 21  1  0  0  0  0
 21 22  1  0  0  0  0
 22 23  1  0  0  0  0
 23 24  1  0  0  0  0
 23 25  2  0  0  0  0
  1 26  2  0  0  0  0
  7 27  2  0  0  0  0
M  END
>  <Mol_ID> (51)
2055

>  <Formula> (51)
C20H32F2O5

>  <MolWeight> (51)
390.4618864

>  <Item Name> (51)
Lubiprostone

>  <Catalog Number> (51)
S1675

>  <Synonyms> (51)
Amitiza, RU-0211, SPI-0211

>  <Target> (51)
Others

>  <Form> (51)
Free Base

>  <URL> (51)
http://www.selleckchem.com/products/Lubiprostone(Amitiza).html

>  <CAS Number> (51)
136790-76-6

$$$$
Tenatoprazole.cdx
csChFnd80/10101813122D

 24 26  0  0  0  0  0  0  0  0999 V2000
    2.4303    2.1009    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    2.4303    0.7009    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
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   10.5096    2.5963    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    9.1104    0.1714    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
   11.2098    1.3834    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   12.6096    1.3834    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   13.3095    2.5958    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   12.6095    3.8082    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   11.2096    3.8082    0.0000 N   0  0  0  0  0  0  0  0  0  0  0  0
   10.5097    0.1708    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   13.3096    0.1709    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
   14.7096    0.1709    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   14.7096    2.5958    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
  1  2  2  0  0  0  0
  2  3  1  0  0  0  0
  3  4  2  0  0  0  0
  4  5  1  0  0  0  0
  5  6  2  0  0  0  0
  6  1  1  0  0  0  0
  4  7  1  0  0  0  0
  7  8  2  0  0  0  0
  8  9  1  0  0  0  0
  9  5  1  0  0  0  0
  2 10  1  0  0  0  0
 10 11  1  0  0  0  0
  8 12  1  0  0  0  0
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 20 14  1  0  0  0  0
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M  END
>  <Mol_ID> (52)
2233

>  <Formula> (52)
C16H18N4O3S

>  <MolWeight> (52)
346.40412

>  <Item Name> (52)
Tenatoprazole

>  <Catalog Number> (52)
S4212

>  <Synonyms> (52)
N/A

>  <Target> (52)
Proton Pump

>  <Form> (52)
Free Base

>  <URL> (52)
http://www.selleckchem.com/products/tenatoprazole.html

>  <CAS Number> (52)
113712-98-4

$$$$
Digoxin .cdx
csChFnd80/10101813122D

 61 68  0  0  0  0  0  0  0  0999 V2000
    6.0622    3.5000    0.0000 C   0  0  2  0  0  0  0  0  0  0  0  0
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    9.6995    4.2000    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
   10.9119    3.5000    0.0000 C   0  0  1  0  0  0  0  0  0  0  0  0
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   13.3368    2.1000    0.0000 C   0  0  1  0  0  0  0  0  0  0  0  0
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   19.3990    5.6000    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
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   23.1553    6.0326    0.0000 C   0  0  2  0  0  0  0  0  0  0  0  0
   23.5879    7.3641    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
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   24.9194    9.1967    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
   23.5879    9.6294    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   22.7650    8.4967    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   23.1553   10.9608    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
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    3.6373    3.5000    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
    2.4249    4.2000    0.0000 C   0  0  1  0  0  0  0  0  0  0  0  0
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    2.4249    1.4000    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
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   21.8238    2.8000    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
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   19.3990    2.8000    0.0000 H   0  0  0  0  0  0  0  0  0  0  0  0
   18.1865    4.9000    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
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   13.3368    0.7000    0.0000 H   0  0  0  0  0  0  0  0  0  0  0  0
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  2  3  1  0  0  0  0
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 10 11  1  0  0  0  0
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 12 13  1  0  0  0  0
 13  8  1  0  0  0  0
 11 14  1  0  0  0  0
 15 14  1  1  0  0  0
 15 16  1  0  0  0  0
 16 17  1  0  0  0  0
 17 18  1  0  0  0  0
 18 19  1  0  0  0  0
 19 20  1  0  0  0  0
 20 15  1  0  0  0  0
 17 21  1  0  0  0  0
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 23 24  1  0  0  0  0
 24 18  1  0  0  0  0
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 25 26  1  0  0  0  0
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 28 24  1  0  0  0  0
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 31 26  1  0  0  0  0
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 36 32  2  0  0  0  0
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  2 38  1  1  0  0  0
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 44 39  1  0  0  0  0
 26 45  1  1  0  0  0
 27 46  1  1  0  0  0
 25 47  1  1  0  0  0
 23 48  1  1  0  0  0
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 18 50  1  1  0  0  0
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 41 58  1  1  0  0  0
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M  END
>  <Mol_ID> (53)
2289

>  <Formula> (53)
C41H64O14

>  <MolWeight> (53)
780.93846

>  <Item Name> (53)
Digoxin

>  <Catalog Number> (53)
S4290

>  <Synonyms> (53)
N/A

>  <Target> (53)
Sodium Channel

>  <Form> (53)
Free Base

>  <URL> (53)
http://www.selleckchem.com/products/digoxin.html

>  <CAS Number> (53)
20830-75-5

$$$$
Procainamide hydrochloride.cdx
csChFnd80/10101813122D

 18 17  0  0  0  0  0  0  0  0999 V2000
    1.2124    2.8000    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    1.2124    4.2000    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    2.4249    4.9000    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    3.6373    4.2000    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    3.6373    2.8000    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    2.4249    2.1000    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    0.0000    4.9000    0.0000 N   0  0  0  0  0  0  0  0  0  0  0  0
    4.8497    2.1000    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
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    7.2746    2.1000    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
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   10.9119    2.8000    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
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   12.1244    2.1000    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
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  1  2  2  0  0  0  0
  2  3  1  0  0  0  0
  3  4  2  0  0  0  0
  4  5  1  0  0  0  0
  5  6  2  0  0  0  0
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 14 17  1  0  0  0  0
M  END
>  <Mol_ID> (54)
2293

>  <Formula> (54)
C13H22ClN3O

>  <MolWeight> (54)
271.78628

>  <Item Name> (54)
Procainamide HCl

>  <Catalog Number> (54)
S4294

>  <Synonyms> (54)
N/A

>  <Target> (54)
Sodium Channel

>  <Form> (54)
Hydrochloride

>  <URL> (54)
http://www.selleckchem.com/products/procainamide-hcl.html

>  <CAS Number> (54)
614-39-1

$$$$
Ouabain Octahydrate.cdx
csChFnd80/10101813122D

 51 48  0  0  0  0  0  0  0  0999 V2000
    9.0948    4.5316    0.0000 C   0  0  2  0  0  0  0  0  0  0  0  0
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M  END
>  <Mol_ID> (55)
2314

>  <Formula> (55)
C29H60O20

>  <MolWeight> (55)
728.7747

>  <Item Name> (55)
Ouabain

>  <Catalog Number> (55)
S4016

>  <Synonyms> (55)
N/A

>  <Target> (55)
Sodium Channel

>  <Form> (55)
Free Base

>  <URL> (55)
http://www.selleckchem.com/products/ouabain.html

>  <CAS Number> (55)
630-60-4

$$$$
levobupivacaine hydrochloride.cdx
csChFnd80/10101813122D

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M  END
>  <Mol_ID> (56)
2376

>  <Formula> (56)
C18H29ClN2O

>  <MolWeight> (56)
324.88866

>  <Item Name> (56)
Levobupivacaine HCl

>  <Catalog Number> (56)
S4061

>  <Synonyms> (56)
N/A

>  <Target> (56)
Sodium Channel

>  <Form> (56)
Hydrochloride

>  <URL> (56)
http://www.selleckchem.com/products/lvobupivacaine-hcl.html

>  <CAS Number> (56)
27262-48-2

$$$$
Endoxifen HCl.cdx
csChFnd80/10101813122D

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M  END
>  <Mol_ID> (57)
2521

>  <Formula> (57)
C25H28ClNO2

>  <MolWeight> (57)
409.94832

>  <Item Name> (57)
Endoxifen HCl

>  <Catalog Number> (57)
S7839

>  <Synonyms> (57)
N/A

>  <Target> (57)
Estrogen/progestogen Receptor

>  <Form> (57)
Hydrochloride

>  <URL> (57)
http://www.selleckchem.com/products/endoxifen-hcl.html

>  <CAS Number> (57)
1032008-74-4

$$$$
Bay K 8644.cdx
csChFnd80/10101813122D

 25 26  0  0  0  0  0  0  0  0999 V2000
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M  END
>  <Mol_ID> (58)
2690

>  <Formula> (58)
C16H15F3N2O4

>  <MolWeight> (58)
356.2965096

>  <Item Name> (58)
Bay K 8644

>  <Catalog Number> (58)
S7924

>  <Synonyms> (58)
N/A

>  <Target> (58)
Calcium Channel

>  <Form> (58)
Free Base

>  <URL> (58)
http://www.selleckchem.com/products/bay-k-8644.html

>  <CAS Number> (58)
71145-03-4

$$$$
S4597 Lercanidipine (hydrochloride).cdx
csChFnd80/10101813122D

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   18.1112    4.8495    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   16.7112    4.8495    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    0.0000    7.2656    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    6.2950    1.4355    0.0000 Cl  0  0  0  0  0  0  0  0  0  0  0  0
  1  2  2  0  0  0  0
  2  3  1  0  0  0  0
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  4  5  2  0  0  0  0
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  1  6  1  0  0  0  0
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  2  7  1  0  0  0  0
 10 11  2  0  0  0  0
 10 12  1  0  0  0  0
  4 10  1  0  0  0  0
 13 14  1  0  0  0  0
 14 15  2  0  0  0  0
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 15 19  1  0  0  0  0
  3 13  1  0  0  0  0
  5 22  1  0  0  0  0
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 28 29  1  0  0  0  0
 30 31  1  0  0  0  0
 31 32  1  0  0  0  0
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 34 35  2  0  0  0  0
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 36 37  2  0  0  0  0
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 33 38  2  0  0  0  0
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 39 40  1  0  0  0  0
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 28 30  1  0  0  0  0
 25 28  1  0  0  0  0
 12 24  1  0  0  0  0
  9 45  1  0  0  0  0
M  END
>  <Mol_ID> (59)
2822

>  <Formula> (59)
C36H42ClN3O6

>  <MolWeight> (59)
648.18818

>  <Item Name> (59)
Lercanidipine (hydrochloride)

>  <Catalog Number> (59)
S4597

>  <Synonyms> (59)
Zanidip (hydrochloride), Masnidipine (hydrochloride)

>  <Target> (59)
Calcium Channel

>  <Form> (59)
hydrochloride

>  <URL> (59)
http://www.selleckchem.com/products/lercanidipine-hydrochloride.html

>  <CAS Number> (59)
132866-11-6

$$$$
S4587 Dithranol.cdx
csChFnd80/10101813122D

 10 11  0  0  0  0  0  0  0  0999 V2000
    1.9269    3.1279    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    3.0422    2.3109    0.0000 N   0  0  0  0  0  0  0  0  0  0  0  0
    2.3675    4.4709    0.0000 N   0  0  0  0  0  0  0  0  0  0  0  0
    0.5805    2.7731    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    4.1891    3.1357    0.0000 N   0  0  0  0  0  0  0  0  0  0  0  0
    3.1085    0.9201    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    3.7682    4.4709    0.0000 N   0  0  0  0  0  0  0  0  0  0  0  0
    0.0000    1.4735    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    2.0507    0.0000    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    0.6986    0.2634    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
  1  2  1  0  0  0  0
  1  3  2  0  0  0  0
  1  4  1  0  0  0  0
  2  5  1  0  0  0  0
  2  6  1  0  0  0  0
  3  7  1  0  0  0  0
  4  8  1  0  0  0  0
  5  7  2  0  0  0  0
  6  9  1  0  0  0  0
  8 10  1  0  0  0  0
  9 10  1  0  0  0  0
M  END
>  <Mol_ID> (60)
2826

>  <Formula> (60)
C6H10N4

>  <MolWeight> (60)
138.1704

>  <Item Name> (60)
Pentylenetetrazol

>  <Catalog Number> (60)
S4587

>  <Synonyms> (60)
	Pentylenetetrazole, Metrazole, pentetrazol, pentamethylenetetrazol, Corazol, Cardiazol, PTZ

>  <Target> (60)
GABA Receptor

>  <Form> (60)
Free Base

>  <URL> (60)
http://www.selleckchem.com/products/pentylenetetrazol.html

>  <CAS Number> (60)
54-95-5

$$$$
S4632 Hexachlorophene.cdx
csChFnd80/10101813122D

 21 22  0  0  0  0  0  0  0  0999 V2000
    5.8674    3.7100    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    4.6534    2.3537    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    5.6676    5.0845    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    7.1583    3.1923    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    2.8344    2.4126    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    6.7574    5.9569    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    8.2676    4.0941    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    7.3683    1.8081    0.0000 Cl  0  0  0  0  0  0  0  0  0  0  0  0
    2.1954    3.6314    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    2.1229    1.2343    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    8.0377    5.4590    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    6.5459    7.3408    0.0000 Cl  0  0  0  0  0  0  0  0  0  0  0  0
    9.5775    3.6000    0.0000 Cl  0  0  0  0  0  0  0  0  0  0  0  0
    0.7683    3.6789    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    0.7389    1.2307    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    2.7832    0.0000    0.0000 Cl  0  0  0  0  0  0  0  0  0  0  0  0
    0.0324    2.5007    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    0.1079    4.9134    0.0000 Cl  0  0  0  0  0  0  0  0  0  0  0  0
    0.0000    0.0416    0.0000 Cl  0  0  0  0  0  0  0  0  0  0  0  0
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  1  2  1  0  0  0  0
  1  3  1  0  0  0  0
  1  4  2  0  0  0  0
  2  5  1  0  0  0  0
  3  6  2  0  0  0  0
  4  7  1  0  0  0  0
  4  8  1  0  0  0  0
  5  9  2  0  0  0  0
  5 10  1  0  0  0  0
  6 11  1  0  0  0  0
  6 12  1  0  0  0  0
  7 13  1  0  0  0  0
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  9 14  1  0  0  0  0
 10 15  2  0  0  0  0
 10 16  1  0  0  0  0
 14 17  2  0  0  0  0
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 15 19  1  0  0  0  0
 15 17  1  0  0  0  0
  3 20  1  0  0  0  0
  9 21  1  0  0  0  0
M  END
>  <Mol_ID> (61)
2842

>  <Formula> (61)
C13H6Cl6O2

>  <MolWeight> (61)
406.90354

>  <Item Name> (61)
Hexachlorophene

>  <Catalog Number> (61)
S4632

>  <Synonyms> (61)
Hexachlorofen, Fostril, Nabac, pHisoHex

>  <Target> (61)
Potassium Channel

>  <Form> (61)
Free Base

>  <URL> (61)
http://www.selleckchem.com/products/hexachlorophene.html

>  <CAS Number> (61)
70-30-4

$$$$
S4630 Diazoxide.cdx
csChFnd80/10101813122D

 14 15  0  0  0  0  0  0  0  0999 V2000
    3.6503    3.4018    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    3.6503    2.0171    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    4.8681    4.0923    0.0000 N   0  0  0  0  0  0  0  0  0  0  0  0
    2.4358    4.0923    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    4.8681    1.3267    0.0000 S   0  0  0  0  0  0  0  0  0  0  0  0
    2.4358    1.3267    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    6.0860    3.4018    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    1.2179    3.4018    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    6.0860    2.0171    0.0000 N   0  0  0  0  0  0  0  0  0  0  0  0
    4.1537    0.0000    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
    5.6436    0.0000    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
    1.2179    2.0171    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    7.3039    4.0923    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    0.0000    1.3267    0.0000 Cl  0  0  0  0  0  0  0  0  0  0  0  0
  1  2  1  0  0  0  0
  1  3  1  0  0  0  0
  1  4  2  0  0  0  0
  2  5  1  0  0  0  0
  2  6  2  0  0  0  0
  3  7  2  0  0  0  0
  4  8  1  0  0  0  0
  5  9  1  0  0  0  0
  5 10  2  0  0  0  0
  5 11  2  0  0  0  0
  6 12  1  0  0  0  0
  7 13  1  0  0  0  0
  7  9  1  0  0  0  0
  8 12  2  0  0  0  0
 12 14  1  0  0  0  0
M  END
>  <Mol_ID> (62)
2843

>  <Formula> (62)
C8H7ClN2O2S

>  <MolWeight> (62)
230.67138

>  <Item Name> (62)
Diazoxide

>  <Catalog Number> (62)
S4630

>  <Synonyms> (62)
Sch-6783, SRG-95213, Proglycem

>  <Target> (62)
Potassium Channel

>  <Form> (62)
Free Base

>  <URL> (62)
http://www.selleckchem.com/products/diazoxide.html

>  <CAS Number> (62)
364-98-7

$$$$
S4669 Benzocaine hydrochloride.cdx
csChFnd80/10101813122D

 13 12  0  0  0  0  0  0  0  0999 V2000
    1.2124    2.1722    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    1.2124    0.7722    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    2.4249    0.0722    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    3.6373    0.7722    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    3.6373    2.1722    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    2.4249    2.8722    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    0.0000    0.0722    0.0000 N   0  0  0  0  0  0  0  0  0  0  0  0
    4.8497    2.8722    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    6.0622    2.1722    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
    4.8497    4.2722    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
    7.2746    2.8722    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    8.4871    2.1722    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    6.0411    0.0000    0.0000 Cl  0  0  0  0  0  0  0  0  0  0  0  0
  1  2  2  0  0  0  0
  2  3  1  0  0  0  0
  3  4  2  0  0  0  0
  4  5  1  0  0  0  0
  5  6  2  0  0  0  0
  6  1  1  0  0  0  0
  2  7  1  0  0  0  0
  5  8  1  0  0  0  0
  8  9  1  0  0  0  0
  8 10  2  0  0  0  0
  9 11  1  0  0  0  0
 11 12  1  0  0  0  0
M  END
>  <Mol_ID> (63)
2926

>  <Formula> (63)
C9H12ClNO2

>  <MolWeight> (63)
201.65008

>  <Item Name> (63)
Benzocaine hydrochloride

>  <Catalog Number> (63)
S4669

>  <Synonyms> (63)
Ethyl 4-aminobenzoate hydrochloride, Benzocaine HCl, Ethyl p-aminobenzoate hydrochloride

>  <Target> (63)
Sodium Channel

>  <Form> (63)
hydrochloride

>  <URL> (63)
http://www.selleckchem.com/products/benzocaine-hydrochloride.html

>  <CAS Number> (63)
23239-88-5

$$$$
S4727 Cinnarizine.cdx
csChFnd80/10101813122D

 28 31  0  0  0  0  0  0  0  0999 V2000
    3.6373    2.8000    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    4.8497    2.1000    0.0000 N   0  0  0  0  0  0  0  0  0  0  0  0
    2.4249    2.1000    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    3.6373    4.2000    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    4.8497    0.7000    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    6.0622    2.8000    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    2.4249    0.7000    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    1.2124    2.8000    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    4.8497    4.9000    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    2.4249    4.9000    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    6.0622    0.0000    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    7.2746    2.1000    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    1.2124    0.0000    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    0.0000    2.1000    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    4.8497    6.3000    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    2.4249    6.3000    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    7.2746    0.7000    0.0000 N   0  0  0  0  0  0  0  0  0  0  0  0
    0.0000    0.7000    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    3.6373    7.0000    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    8.4870    0.0000    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    9.6995    0.7000    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   10.9119    0.0000    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   12.1244    0.7000    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   13.3368    0.0000    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   12.1244    2.1000    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   14.5492    0.7000    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   13.3368    2.8000    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
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  1  3  1  0  0  0  0
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  2  5  1  0  0  0  0
  2  6  1  0  0  0  0
  3  7  1  0  0  0  0
  3  8  2  0  0  0  0
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  4 10  1  0  0  0  0
  5 11  1  0  0  0  0
  6 12  1  0  0  0  0
  7 13  2  0  0  0  0
  8 14  1  0  0  0  0
  9 15  1  0  0  0  0
 10 16  2  0  0  0  0
 11 17  1  0  0  0  0
 12 17  1  0  0  0  0
 13 18  1  0  0  0  0
 14 18  2  0  0  0  0
 15 19  2  0  0  0  0
 16 19  1  0  0  0  0
 17 20  1  0  0  0  0
 20 21  1  0  0  0  0
 21 22  2  0  0  0  0
 22 23  1  0  0  0  0
 23 24  2  0  0  0  0
 23 25  1  0  0  0  0
 24 26  1  0  0  0  0
 25 27  2  0  0  0  0
 26 28  2  0  0  0  0
 27 28  1  0  0  0  0
M  END
>  <Mol_ID> (64)
2979

>  <Formula> (64)
C26H28N2

>  <MolWeight> (64)
368.51392

>  <Item Name> (64)
Cinnarizine

>  <Catalog Number> (64)
S4727

>  <Synonyms> (64)
Stugeron|Dimitronal|Stutgin|Cinarizine

>  <Target> (64)
Calcium Channel

>  <Form> (64)
Free Base

>  <URL> (64)
http://www.selleckchem.com/products/cinnarizine.html

>  <CAS Number> (64)
298-57-7

$$$$
S4714 (-)-Menthol.cdx
csChFnd80/10101813122D

 11 11  0  0  0  0  0  0  0  0999 V2000
    3.6235    2.1002    0.0000 C   0  0  1  0  0  0  0  0  0  0  0  0
    3.6192    3.4946    0.0000 C   0  0  1  0  0  0  0  0  0  0  0  0
    2.4011    1.4033    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    4.8359    1.4002    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    2.4234    4.1998    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    4.8316    4.1946    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
    1.2017    2.1131    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    6.0480    2.1000    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    4.8359    0.0000    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    1.2124    3.5174    0.0000 C   0  0  1  0  0  0  0  0  0  0  0  0
    0.0000    4.2174    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
  1  2  1  0  0  0  0
  1  3  1  0  0  0  0
  1  4  1  6  0  0  0
  2  5  1  0  0  0  0
  2  6  1  1  0  0  0
  3  7  1  0  0  0  0
  4  8  1  0  0  0  0
  4  9  1  0  0  0  0
  5 10  1  0  0  0  0
  7 10  1  0  0  0  0
 10 11  1  1  0  0  0
M  END
>  <Mol_ID> (65)
2990

>  <Formula> (65)
C10H20O

>  <MolWeight> (65)
156.2652

>  <Item Name> (65)
(-)-Menthol

>  <Catalog Number> (65)
S4714

>  <Synonyms> (65)
L-Menthol|Levomenthol|Menthomenthol|Menthacamphor

>  <Target> (65)
Others

>  <Form> (65)
Free Base

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http://www.selleckchem.com/products/-menthol.html

>  <CAS Number> (65)
2216-51-5

$$$$
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Free Base

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517-89-5

$$$$
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Pantoprazole (Protonix)

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S2105

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N/A

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Proton Pump

>  <Form> (67)
Free Base

>  <URL> (67)
http://www.selleckchem.com/products/pantoprazole-protonix.html

>  <CAS Number> (67)
102625-70-7

$$$$
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csChFnd80/10101813122D

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Calcium Channel

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http://www.selleckchem.com/products/ym-58483-btp2.html

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223499-30-7

$$$$
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3077

>  <Formula> (69)
C16H18FN3O2

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>  <Item Name> (69)
Retigabine

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>  <Synonyms> (69)
N-(2-amino-4-[fluorobenzylamino]-phenyl) carbamic acid|D-23129

>  <Target> (69)
Potassium Channel

>  <Form> (69)
Free Base

>  <URL> (69)
http://www.selleckchem.com/products/retigabine.html

>  <CAS Number> (69)
150812-12-7

$$$$
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free base

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475205-49-3 

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761423-87-4

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$$$$
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   12.0828    0.0000    0.0000 N   0  0  0  0  0  0  0  0  0  0  0  0
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   10.8341    2.2200    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
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  7  1  1  0  0  0  0
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  3  9  1  6  0  0  0
 13  4  1  0  0  0  0
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 16  5  1  0  0  0  0
 12  7  2  0  0  0  0
 14  7  1  0  0  0  0
 11  8  2  0  0  0  0
 15  8  1  0  0  0  0
 10  9  1  0  0  0  0
 19  9  2  0  0  0  0
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 27 23  1  0  0  0  0
 28 26  2  0  0  0  0
M  END
>  <Mol_ID> (74)
3338

>  <Formula> (74)
C20H25ClN2O5

>  <MolWeight> (74)
408.8759

>  <Item Name> (74)
Levamlodipine

>  <Catalog Number> (74)
S3674

>  <Synonyms> (74)
S-amlodipine

>  <Target> (74)
calcium channel

>  <Form> (74)
free base

>  <URL> (74)
http://www.selleckchem.com/products/levamlodipine.html

>  <CAS Number> (74)
103129-82-4

$$$$
S3713 Moxidectin.cdx
csChFnd80/10101813122D

 48 52  0  0  0  0  0  0  0  0999 V2000
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M  END
>  <Mol_ID> (75)
3346

>  <Formula> (75)
C37H53NO8

>  <MolWeight> (75)
639.81862

>  <Item Name> (75)
Moxidectin

>  <Catalog Number> (75)
S3713

>  <Synonyms> (75)
milbemycin B

>  <Target> (75)
Antifection

>  <Form> (75)
free base

>  <URL> (75)
http://www.selleckchem.com/products/moxidectin.html

>  <CAS Number> (75)
113507-06-5

$$$$
S3642 Cesium chloride.cdx
csChFnd80/10101813122D

  2  1  0  0  0  0  0  0  0  0999 V2000
    0.0000    0.0000    0.0000 Cs  0  0  0  0  0  0  0  0  0  0  0  0
    1.4000    0.0000    0.0000 Cl  0  0  0  0  0  0  0  0  0  0  0  0
  1  2  1  0  0  0  0
M  END
>  <Mol_ID> (76)
3411

>  <Formula> (76)
ClCs

>  <MolWeight> (76)
168.35845

>  <Item Name> (76)
Cesium chloride

>  <Catalog Number> (76)
S3642

>  <Synonyms> (76)
CsCl

>  <Target> (76)
Others

>  <Form> (76)
inorganic salt

>  <URL> (76)
http://www.selleckchem.com/products/cesium-chloride.html

>  <CAS Number> (76)
7647-17-8

$$$$
S3751 Quinidine sulfate.cdx
csChFnd80/10101813122D

 59 62  0  0  0  0  0  0  0  0999 V2000
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   21.4929    4.9788    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
   24.3212    4.9788    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
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   22.8927    6.3569    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
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    8.0306   15.0399    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
   13.4681    2.1811    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   14.7664    2.8552    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   13.4644    0.7099    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   12.2802    2.8801    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   14.7664    4.2548    0.0000 C   0  0  1  0  0  0  0  0  0  0  0  0
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M  END
>  <Mol_ID> (77)
3430

>  <Formula> (77)
C40H54N4O10S

>  <MolWeight> (77)
782.94256

>  <Item Name> (77)
Quinidine sulfate

>  <Catalog Number> (77)
S3751

>  <Synonyms> (77)
Chinidin Sodium, Pitayine Sodium, ¦Â-quinine Sodium, (+)-quinidine Sodium

>  <Target> (77)
sodium channels

>  <Form> (77)
sulfate dihydrate

>  <URL> (77)
http://www.selleckchem.com/products/quinidine-sulfate.html

>  <CAS Number> (77)
6591-63-5

$$$$
S3959 (+)-Borneol.cdx
csChFnd80/10101813122D

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M  END
>  <Mol_ID> (78)
3479

>  <Formula> (78)
C10H18O

>  <MolWeight> (78)
154.24932

>  <Item Name> (78)
(+)-Borneol

>  <Catalog Number> (78)
S3959

>  <Synonyms> (78)
N/A

>  <Target> (78)
Others

>  <Form> (78)
free base

>  <URL> (78)
http://www.selleckchem.com/products/positive-rotation-borneol.html

>  <CAS Number> (78)
464-43-7

$$$$
S3911 Veratramine.cdx
csChFnd80/10101813122D

 33 37  0  0  0  0  0  0  0  0999 V2000
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 29 30  1  1  0  0  0
M  END
>  <Mol_ID> (79)
3546

>  <Formula> (79)
C27H39NO2

>  <MolWeight> (79)
409.60406

>  <Item Name> (79)
Veratramine

>  <Catalog Number> (79)
S3911

>  <Synonyms> (79)
NSC 17821, NSC 23880

>  <Target> (79)
Sodium Channel

>  <Form> (79)
free base

>  <URL> (79)
http://www.selleckchem.com/products/veratramine.html

>  <CAS Number> (79)
60-70-8

$$$$
S3883 Protopine.cdx
csChFnd80/10101813122D

 26 30  0  0  0  0  0  0  0  0999 V2000
    4.5804    3.5000    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
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M  END
>  <Mol_ID> (80)
3593

>  <Formula> (80)
C20H19NO5

>  <MolWeight> (80)
353.36856

>  <Item Name> (80)
Protopine

>  <Catalog Number> (80)
S3883

>  <Synonyms> (80)
Corydinine, Fumarine, Biflorine, Macleyine

>  <Target> (80)
Calcium channel/Histamine Receptor

>  <Form> (80)
free base

>  <URL> (80)
http://www.selleckchem.com/products/protopine.html

>  <CAS Number> (80)
130-86-9

$$$$
S3807 Dehydroandrographolide.cdx
csChFnd80/10101813122D

 25 27  0  0  0  0  0  0  0  0999 V2000
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  1  4  1  0  0  0  0
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  2  5  1  0  0  0  0
  2  6  1  0  0  0  0
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  3  9  1  0  0  0  0
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M  END
>  <Mol_ID> (81)
3600

>  <Formula> (81)
C20H28O4

>  <MolWeight> (81)
332.43392

>  <Item Name> (81)
Dehydroandrographolide

>  <Catalog Number> (81)
S3807

>  <Synonyms> (81)
N/A

>  <Target> (81)
Others

>  <Form> (81)
free base

>  <URL> (81)
http://www.selleckchem.com/products/dehydroandrographolide.html

>  <CAS Number> (81)
134418-28-3

$$$$
S3809 Imperatorin.cdx
csChFnd80/10101813122D

 20 22  0  0  0  0  0  0  0  0999 V2000
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M  END
>  <Mol_ID> (82)
3602

>  <Formula> (82)
C16H14O4

>  <MolWeight> (82)
270.27996

>  <Item Name> (82)
Imperatorin

>  <Catalog Number> (82)
S3809

>  <Synonyms> (82)
Ammidin, Marmelosin, Pentosalen, 8-Isoamylenoxypsoralen, 8-Isopentenyloxypsoralene

>  <Target> (82)
Calcium channel

>  <Form> (82)
free base

>  <URL> (82)
http://www.selleckchem.com/products/imperatorin.html

>  <CAS Number> (82)
482-44-0

$$$$
S3907 Bulleyaconi cine A.cdx
csChFnd80/10101813122D

 49 55  0  0  0  0  0  0  0  0999 V2000
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M  END
>  <Mol_ID> (83)
3652

>  <Formula> (83)
C35H49NO9

>  <MolWeight> (83)
627.76486

>  <Item Name> (83)
Bulleyaconi cine A

>  <Catalog Number> (83)
S3907

>  <Synonyms> (83)
Bulleyaconitine A, Bulleyaconi cine A

>  <Target> (83)
Sodium channel

>  <Form> (83)
free base

>  <URL> (83)
http://www.selleckchem.com/products/bulleyaconi-cine-a.html

>  <CAS Number> (83)
107668-79-1

$$$$
S3905 Iso-Steviol.cdx
csChFnd80/10101813122D

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M  END
>  <Mol_ID> (84)
3689

>  <Formula> (84)
C20H30O3

>  <MolWeight> (84)
318.4504

>  <Item Name> (84)
Iso-Steviol

>  <Catalog Number> (84)
S3905

>  <Synonyms> (84)
N/A

>  <Target> (84)
Others

>  <Form> (84)
free base

>  <URL> (84)
http://www.selleckchem.com/products/iso-steviol.html

>  <CAS Number> (84)
27975-19-5

$$$$
S3816 Dehydroevodiamine.cdx
csChFnd80/10101813122D

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M  END
>  <Mol_ID> (85)
3705

>  <Formula> (85)
C19H15N3O

>  <MolWeight> (85)
301.3419

>  <Item Name> (85)
Dehydroevodiamine

>  <Catalog Number> (85)
S3816

>  <Synonyms> (85)
DHED

>  <Target> (85)
Others

>  <Form> (85)
inner salt

>  <URL> (85)
http://www.selleckchem.com/products/dehydroevodiamine.html

>  <CAS Number> (85)
67909-49-3

$$$$
S4772 alpha-Asarone.cdx
csChFnd80/10101813122D

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>  <Mol_ID> (86)
3737

>  <Formula> (86)
C12H16O3

>  <MolWeight> (86)
208.25364

>  <Item Name> (86)
alpha-Asarone

>  <Catalog Number> (86)
S4772

>  <Synonyms> (86)
trans-Asarone

>  <Target> (86)
Others

>  <Form> (86)
free base

>  <URL> (86)
http://www.selleckchem.com/products/alpha-asarone.html

>  <CAS Number> (86)
2883-98-9

$$$$
ML204.cdx
csChFnd80/10101813122D

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M  END
>  <Mol_ID> (87)
3793

>  <Formula> (87)
C15H18N2

>  <MolWeight> (87)
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ML204

>  <Catalog Number> (87)
S8691

>  <Synonyms> (87)
N/A

>  <Target> (87)
TRPC4

>  <Form> (87)
free base

>  <URL> (87)
http://www.selleckchem.com/products/ml204.html

>  <CAS Number> (87)
5465-86-1

$$$$
S3977 (-)-Borneol.cdx
csChFnd80/10101813122D

 12 13  0  0  0  0  0  0  0  0999 V2000
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M  END
>  <Mol_ID> (88)
3797

>  <Formula> (88)
C10H18O

>  <MolWeight> (88)
154.24932

>  <Item Name> (88)
(-)-Borneol

>  <Catalog Number> (88)
S3977

>  <Synonyms> (88)
L-Borneol

>  <Target> (88)
Others

>  <Form> (88)
free base

>  <URL> (88)
http://www.selleckchem.com/products/l-borneol.html

>  <CAS Number> (88)
464-45-9

$$$$
S3074 Chlortalidone.cdx
csChFnd80/10101813122D

 22 24  0  0  0  0  0  0  0  0999 V2000
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M  END
>  <Mol_ID> (89)
3846

>  <Formula> (89)
C14H11ClN2O4S

>  <MolWeight> (89)
338.76614

>  <Item Name> (89)
Chlorthalidone

>  <Catalog Number> (89)
S3074

>  <Synonyms> (89)
Chlortalidone

>  <Target> (89)
Others

>  <Form> (89)
free base

>  <URL> (89)
http://selleckchem.com/products/chlorthalidone-chlortalidone.html

>  <CAS Number> (89)
77-36-1

$$$$
S5058 Revaprazan Hydrochloride.cdx
csChFnd80/10101813122D

 28 30  0  0  0  0  0  0  0  0999 V2000
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>  <Mol_ID> (90)
3900

>  <Formula> (90)
C22H24ClFN4

>  <MolWeight> (90)
398.9041632

>  <Item Name> (90)
Revaprazan Hydrochloride

>  <Catalog Number> (90)
S5058

>  <Synonyms> (90)
YH1885

>  <Target> (90)
Proton Pump

>  <URL> (90)
http://selleckchem.com/products/revaprazan-hydrochloride.html

>  <CAS Number> (90)
178307-42-1

$$$$
DIPRIVAN (propofol).cdx
csChFnd80/10101813122D

 13 13  0  0  0  0  0  0  0  0999 V2000
    2.4249    2.1073    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
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M  END
>  <Mol_ID> (91)
3940

>  <Formula> (91)
C12H18O

>  <MolWeight> (91)
178.27072

>  <Item Name> (91)
Propofol

>  <Catalog Number> (91)
S2023

>  <Synonyms> (91)
N/A

>  <Target> (91)
GABA Receptor

>  <URL> (91)
http://selleckchem.com/products/propofol-diprivan.html

>  <CAS Number> (91)
2078-54-8

$$$$
S4892 Phenibut.cdx
csChFnd80/10101813122D

 13 13  0  0  0  0  0  0  0  0999 V2000
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>  <Mol_ID> (92)
3951

>  <Formula> (92)
C10H13NO2

>  <MolWeight> (92)
179.21572

>  <Item Name> (92)
Phenibut

>  <Catalog Number> (92)
S4892

>  <Synonyms> (92)
Aminophenylbutyric acid, Fenibut, Fenigam, Phenigam, Phenybut, PhGABA, ¦Â-Phenyl-¦Ã-aminobutyric acid

>  <Target> (92)
GABA Receptor

>  <Form> (92)
free base

>  <URL> (92)
http://selleckchem.com/products/phenibut.html

>  <CAS Number> (92)
1078-21-3

$$$$
S4977 Efonidipine.cdx
csChFnd80/10101813122D

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    8.6746    7.0000    0.0000 N   0  3  0  0  0  0  0  0  0  0  0  0
    8.6746    8.4000    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
    9.8870    6.3000    0.0000 O   0  5  0  0  0  0  0  0  0  0  0  0
    3.8249    1.4000    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
  1  2  2  0  0  0  0
  2  3  1  0  0  0  0
  3  4  2  0  0  0  0
  4  5  1  0  0  0  0
  5  6  2  0  0  0  0
  6  1  1  0  0  0  0
  3  7  1  0  0  0  0
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  7  9  1  0  0  0  0
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 13 15  2  0  0  0  0
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 17 18  2  0  0  0  0
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 20 14  2  0  0  0  0
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 25 12  1  0  0  0  0
 16 26  1  0  0  0  0
 26 27  2  0  0  0  0
 27 28  1  0  0  0  0
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 29 30  1  0  0  0  0
 30 31  2  0  0  0  0
 31 26  1  0  0  0  0
 18 32  1  0  0  0  0
 20 33  1  0  0  0  0
 17 34  1  0  0  0  0
 34 35  1  0  0  0  0
 35 36  1  0  0  0  0
 36 37  1  0  0  0  0
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 38 39  1  0  0  0  0
 39 34  1  0  0  0  0
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 34 45  2  0  0  0  0
 42 43  2  0  0  0  0
 42 44  1  0  0  0  0
M  END
>  <Mol_ID> (93)
4019

>  <Formula> (93)
C34H38N3O7P

>  <MolWeight> (93)
631.655181

>  <Item Name> (93)
Efonidipine

>  <Catalog Number> (93)
S4977

>  <Synonyms> (93)
NZ-105

>  <Target> (93)
Calcium Channel

>  <Form> (93)
free base

>  <URL> (93)
http://selleckchem.com/products/efonidipine.html

>  <CAS Number> (93)
111011-63-3

$$$$
Sodium valproate.cdx
csChFnd80/10101813122D

 11 10  0  0  0  0  0  0  0  0999 V2000
    0.0000    4.2000    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    1.2124    3.5000    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    2.4249    4.2000    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    3.6373    3.5000    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    4.8497    4.2000    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    6.0622    3.5000    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
    7.2746    4.2000    0.0000 Na  0  0  0  0  0  0  0  0  0  0  0  0
    4.8497    5.6000    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
    3.6373    2.1000    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    4.8497    1.4000    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    4.8497    0.0000    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
  1  2  1  0  0  0  0
  2  3  1  0  0  0  0
  3  4  1  0  0  0  0
  4  5  1  0  0  0  0
  5  6  1  0  0  0  0
  5  8  2  0  0  0  0
  4  9  1  0  0  0  0
  9 10  1  0  0  0  0
 10 11  1  0  0  0  0
  6  7  1  0  0  0  0
M  END
>  <Mol_ID> (94)
4052

>  <Formula> (94)
C8H15NaO2

>  <MolWeight> (94)
166.19327

>  <Item Name> (94)
Valproic acid sodium salt (Sodium valproate)

>  <Catalog Number> (94)
S1168

>  <Synonyms> (94)
N/A 

>  <Target> (94)
GABA Receptor, HDAC

>  <URL> (94)
http://www.selleckchem.com/products/Sodium-valproate.html

>  <CAS Number> (94)
1069-66-5, 99-66-1 (FREE BASE)

$$$$
S5222 Coluracetam.cdx
csChFnd80/10101813122D

 25 28  0  0  0  0  0  0  0  0999 V2000
    5.8263    2.8165    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    7.0454    2.0808    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    4.6072    2.1229    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
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    7.0454    0.6936    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    8.3653    2.5516    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    4.6072    0.7314    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    3.4176    2.8416    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    4.6366    4.9645    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    5.8010    0.0000    0.0000 N   0  0  0  0  0  0  0  0  0  0  0  0
    8.3653    0.2900    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
    9.2060    1.3872    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    8.7605    3.8884    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    3.3670    0.0672    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    2.1480    2.1858    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    3.4427    4.2709    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    4.6366    6.3644    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
   10.5932    1.3872    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
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  1  2  1  0  0  0  0
  1  3  2  0  0  0  0
  1  4  1  0  0  0  0
  2  5  2  0  0  0  0
  2  6  1  0  0  0  0
  3  7  1  0  0  0  0
  3  8  1  0  0  0  0
  4  9  1  0  0  0  0
  5 10  1  0  0  0  0
  5 11  1  0  0  0  0
  6 12  2  0  0  0  0
  6 13  1  0  0  0  0
  7 14  1  0  0  0  0
  7 10  2  0  0  0  0
  8 15  1  0  0  0  0
  9 16  1  0  0  0  0
  9 17  2  0  0  0  0
 11 12  1  0  0  0  0
 12 18  1  0  0  0  0
 14 19  1  0  0  0  0
 15 19  1  0  0  0  0
 16 20  1  0  0  0  0
 20 21  1  0  0  0  0
 20 22  1  0  0  0  0
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 22 25  1  0  0  0  0
 23 25  1  0  0  0  0
M  END
>  <Mol_ID> (95)
4059

>  <Formula> (95)
C19H23N3O3

>  <MolWeight> (95)
341.40422

>  <Item Name> (95)
Coluracetam

>  <Catalog Number> (95)
S5222

>  <Synonyms> (95)
MKC-231, BCI-540

>  <Target> (95)
Others

>  <Form> (95)
free base

>  <URL> (95)
http://selleckchem.com/products/coluracetam.html

>  <CAS Number> (95)
135463-81-9

$$$$
S5223 Phenylpiracetam.cdx
csChFnd80/10101813122D

 16 17  0  0  0  0  0  0  0  0999 V2000
    2.9857    3.6473    0.0000 C   0  0  3  0  0  0  0  0  0  0  0  0
    3.6857    2.4348    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    3.5556    4.9408    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    1.5995    3.7872    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    2.9898    1.2204    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    5.0960    2.4421    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    2.4979    5.8645    0.0000 N   0  0  0  0  0  0  0  0  0  0  0  0
    1.2834    5.1643    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    3.6962    0.0000    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    5.7962    1.2325    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    2.6341    7.2578    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    0.0000    5.7238    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
    5.1065    0.0086    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    3.8924    7.8716    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    5.0531    7.0887    0.0000 N   0  0  0  0  0  0  0  0  0  0  0  0
    3.9901    9.2682    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
  1  2  1  0  0  0  0
  1  3  1  0  0  0  0
  1  4  1  0  0  0  0
  2  5  2  0  0  0  0
  2  6  1  0  0  0  0
  3  7  1  0  0  0  0
  4  8  1  0  0  0  0
  5  9  1  0  0  0  0
  6 10  2  0  0  0  0
  7 11  1  0  0  0  0
  7  8  1  0  0  0  0
  8 12  2  0  0  0  0
  9 13  2  0  0  0  0
 10 13  1  0  0  0  0
 11 14  1  0  0  0  0
 14 15  1  0  0  0  0
 14 16  2  0  0  0  0
M  END
>  <Mol_ID> (96)
4084

>  <Formula> (96)
C12H14N2O2

>  <MolWeight> (96)
218.25176

>  <Item Name> (96)
Phenylpiracetam

>  <Catalog Number> (96)
S5223

>  <Synonyms> (96)
Phenotropil, Carphedon, 4-Phenylpiracetam

>  <Target> (96)
Others

>  <Form> (96)
free base

>  <URL> (96)
http://selleckchem.com/products/phenylpiracetam.html

>  <CAS Number> (96)
77472-70-9

$$$$
S5229 Isosorbide dinitrate.cdx
csChFnd80/10101813122D

 18 19  0  0  0  0  0  0  0  0999 V2000
    4.1387    3.3835    0.0000 C   0  0  1  0  0  0  0  0  0  0  0  0
    4.1387    4.7729    0.0000 C   0  0  1  0  0  0  0  0  0  0  0  0
    5.4563    2.9667    0.0000 C   0  0  1  0  0  0  0  0  0  0  0  0
    2.7807    2.9445    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
    2.7629    5.1851    0.0000 C   0  0  2  0  0  0  0  0  0  0  0  0
    5.4204    5.2121    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
    6.2540    4.0873    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    5.8866    1.6224    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
    1.9293    4.0737    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    2.3237    6.5386    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
    7.2758    1.3400    0.0000 N   0  3  0  0  0  0  0  0  0  0  0  0
    0.9492    6.8536    0.0000 N   0  3  0  0  0  0  0  0  0  0  0  0
    7.7238    0.0000    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
    8.1900    2.3573    0.0000 O   0  5  0  0  0  0  0  0  0  0  0  0
    0.5711    8.2070    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
    0.0000    5.8496    0.0000 O   0  5  0  0  0  0  0  0  0  0  0  0
    4.1433    1.9943    0.0000 H   0  0  0  0  0  0  0  0  0  0  0  0
    4.1073    6.1666    0.0000 H   0  0  0  0  0  0  0  0  0  0  0  0
  1  2  1  0  0  0  0
  1  3  1  0  0  0  0
  1  4  1  0  0  0  0
  1 17  1  6  0  0  0
  2  5  1  0  0  0  0
  2  6  1  0  0  0  0
  2 18  1  6  0  0  0
  3  7  1  0  0  0  0
  3  8  1  1  0  0  0
  4  9  1  0  0  0  0
  5 10  1  6  0  0  0
  5  9  1  0  0  0  0
  6  7  1  0  0  0  0
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 10 12  1  0  0  0  0
 11 13  2  0  0  0  0
 11 14  1  0  0  0  0
 12 15  2  0  0  0  0
 12 16  1  0  0  0  0
M  END
>  <Mol_ID> (97)
4090

>  <Formula> (97)
C6H8N2O8

>  <MolWeight> (97)
236.13632

>  <Item Name> (97)
Isosorbide dinitrate

>  <Catalog Number> (97)
S5229

>  <Synonyms> (97)
Sorbide nitrate, Sorbidnitrate, Isordil, Nitrosorbide

>  <Target> (97)
Others

>  <Form> (97)
free base

>  <URL> (97)
http://selleckchem.com/products/isosorbide-dinitrate.html

>  <CAS Number> (97)
87-33-2

$$$$
S5274 GS967.cdx
csChFnd80/10101813122D

 24 26  0  0  0  0  0  0  0  0999 V2000
    9.7001    0.7019    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    8.4887    0.0000    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    7.2753    0.6981    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    7.2725    2.0971    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    8.4843    2.8000    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    9.6979    2.1019    0.0000 N   0  0  0  0  0  0  0  0  0  0  0  0
   11.8533    1.4053    0.0000 N   0  0  0  0  0  0  0  0  0  0  0  0
   11.0322    0.2713    0.0000 N   0  0  0  0  0  0  0  0  0  0  0  0
   11.0286    2.5366    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   11.4592    3.8687    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   11.8897    5.2009    0.0000 F   0  0  0  0  0  0  0  0  0  0  0  0
   12.7913    3.4382    0.0000 F   0  0  0  0  0  0  0  0  0  0  0  0
   10.1270    4.2993    0.0000 F   0  0  0  0  0  0  0  0  0  0  0  0
    6.0601    2.7971    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    4.8482    2.0942    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    3.6346    2.7923    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    3.6283    4.1852    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    4.8437    4.8942    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
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  2  3  2  0  0  0  0
  3  4  1  0  0  0  0
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  1  6  1  0  0  0  0
  7  8  1  0  0  0  0
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  6  9  1  0  0  0  0
  1  8  2  0  0  0  0
 10 11  1  0  0  0  0
 10 12  1  0  0  0  0
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  9 10  1  0  0  0  0
 14 15  1  0  0  0  0
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 17 18  2  0  0  0  0
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 21 23  1  0  0  0  0
 21 24  1  0  0  0  0
 17 20  1  0  0  0  0
  4 14  1  0  0  0  0
M  END
>  <Mol_ID> (98)
4095

>  <Formula> (98)
C14H7F6N3O

>  <MolWeight> (98)
347.2152992

>  <Item Name> (98)
 GS967

>  <Catalog Number> (98)
S5274

>  <Synonyms> (98)
GS458967

>  <Target> (98)
Sodium Channel

>  <Form> (98)
free base

>  <URL> (98)
http://selleckchem.com/products/gs967.html

>  <CAS Number> (98)
1262618-39-2

$$$$
S5253 Cisapride.cdx
csChFnd80/10101813122D

 32 34  0  0  0  0  0  0  0  0999 V2000
    3.6373    2.1000    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    3.6373    0.7000    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    4.8497    2.8000    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
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    2.4249    0.0000    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
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    6.0622    2.1000    0.0000 N   0  0  0  0  0  0  0  0  0  0  0  0
    4.8497    4.2000    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
    1.2124    2.1000    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    1.2124    0.7000    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    6.0622    0.7000    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    7.2746    2.8000    0.0000 C   0  0  2  0  0  0  0  0  0  0  0  0
    0.0000    2.8000    0.0000 Cl  0  0  0  0  0  0  0  0  0  0  0  0
    0.0000    0.0000    0.0000 N   0  0  0  0  0  0  0  0  0  0  0  0
    8.4870    2.1000    0.0000 C   0  0  1  0  0  0  0  0  0  0  0  0
    7.2746    4.2000    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    9.6995    2.8000    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    8.4870    0.7000    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
    8.4870    4.9000    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    9.6995    4.2000    0.0000 N   0  0  0  0  0  0  0  0  0  0  0  0
    7.2746    0.0000    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   10.9119    4.9000    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   12.1244    4.2000    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   13.3368    4.9000    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   14.5492    4.2000    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
   15.7617    4.9000    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   15.7617    6.3000    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   16.9741    4.2000    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   16.9741    7.0000    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   18.1865    4.9000    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   18.1865    6.3000    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   19.3990    7.0000    0.0000 F   0  0  0  0  0  0  0  0  0  0  0  0
  1  2  2  0  0  0  0
  1  3  1  0  0  0  0
  1  4  1  0  0  0  0
  2  5  1  0  0  0  0
  2  6  1  0  0  0  0
  3  7  1  0  0  0  0
  3  8  2  0  0  0  0
  4  9  2  0  0  0  0
  5 10  2  0  0  0  0
  6 11  1  0  0  0  0
 12  7  1  1  0  0  0
  9 13  1  0  0  0  0
  9 10  1  0  0  0  0
 10 14  1  0  0  0  0
 12 15  1  0  0  0  0
 12 16  1  0  0  0  0
 15 17  1  0  0  0  0
 15 18  1  1  0  0  0
 16 19  1  0  0  0  0
 17 20  1  0  0  0  0
 18 21  1  0  0  0  0
 19 20  1  0  0  0  0
 20 22  1  0  0  0  0
 22 23  1  0  0  0  0
 23 24  1  0  0  0  0
 24 25  1  0  0  0  0
 25 26  1  0  0  0  0
 26 27  1  0  0  0  0
 26 28  2  0  0  0  0
 27 29  2  0  0  0  0
 28 30  1  0  0  0  0
 29 31  1  0  0  0  0
 30 31  2  0  0  0  0
 31 32  1  0  0  0  0
M  END
>  <Mol_ID> (99)
4118

>  <Formula> (99)
C23H29ClFN3O4

>  <MolWeight> (99)
465.9454632

>  <Item Name> (99)
Cisapride

>  <Catalog Number> (99)
S5253

>  <Synonyms> (99)
Kaudalit, Kinestase, Prepulsid, Presid, Pridesia, Propulsid

>  <Target> (99)
5-HT Receptor

>  <URL> (99)
http://selleckchem.com/products/cisapride.html

>  <CAS Number> (99)
81098-60-4

$$$$
S5490 Disopyramide.cdx
csChFnd80/10101813122D

 25 26  0  0  0  0  0  0  0  0999 V2000
    2.8000    4.8497    0.0000 C   0  0  3  0  0  0  0  0  0  0  0  0
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    4.0124    5.5497    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    3.5000    3.6373    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    1.5876    4.1497    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    0.7000    6.0622    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    2.8000    7.2746    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    4.0124    6.9497    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    5.2249    4.8497    0.0000 N   0  0  0  0  0  0  0  0  0  0  0  0
    4.9000    3.6373    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    0.3751    4.8497    0.0000 N   0  0  0  0  0  0  0  0  0  0  0  0
    1.5876    2.7497    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
    0.0000    7.2746    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
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    4.9000    1.2124    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
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    3.5000    1.2124    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    5.6000    0.0000    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
  1  2  1  0  0  0  0
  1  3  1  0  0  0  0
  1  4  1  0  0  0  0
  1  5  1  0  0  0  0
  2  6  1  0  0  0  0
  2  7  2  0  0  0  0
  3  8  1  0  0  0  0
  3  9  2  0  0  0  0
  4 10  1  0  0  0  0
  5 11  1  0  0  0  0
  5 12  2  0  0  0  0
  6 13  2  0  0  0  0
  7 14  1  0  0  0  0
  8 15  2  0  0  0  0
  9 16  1  0  0  0  0
 10 17  1  0  0  0  0
 13 18  1  0  0  0  0
 14 18  2  0  0  0  0
 15 19  1  0  0  0  0
 16 19  2  0  0  0  0
 17 20  1  0  0  0  0
 17 21  1  0  0  0  0
 20 22  1  0  0  0  0
 20 23  1  0  0  0  0
 21 24  1  0  0  0  0
 21 25  1  0  0  0  0
M  END
>  <Mol_ID> (100)
4127

>  <Formula> (100)
C21H29N3O

>  <MolWeight> (100)
339.47446

>  <Item Name> (100)
Disopyramide

>  <Catalog Number> (100)
S5490

>  <Synonyms> (100)
N/A

>  <Target> (100)
Sodium Channel

>  <URL> (100)
http://selleckchem.com/products/disopyramide.html

>  <CAS Number> (100)
3737-09-5

$$$$
S5279 Fendiline hydrochloride.cdx
csChFnd80/10101813122D

 25 26  0  0  0  0  0  0  0  0999 V2000
    3.6324    3.4790    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    2.4239    2.7812    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    3.6324    4.8744    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    4.8411    2.7812    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    2.4239    1.3793    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    1.2124    3.4807    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    4.8408    5.5721    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    2.4119    5.5791    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    6.0496    3.4789    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    1.2106    0.6788    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    0.0000    2.7807    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    4.8408    6.9764    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    2.4119    6.9788    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
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    8.4667    3.4789    0.0000 C   0  0  3  0  0  0  0  0  0  0  0  0
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   10.8882    3.4814    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   10.8881    0.6809    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   12.1008    2.7814    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   12.1009    1.3811    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    7.2031    0.0000    0.0000 Cl  0  0  0  0  0  0  0  0  0  0  0  0
  1  2  1  0  0  0  0
  1  3  1  0  0  0  0
  1  4  1  0  0  0  0
  2  5  1  0  0  0  0
  2  6  2  0  0  0  0
  3  7  2  0  0  0  0
  3  8  1  0  0  0  0
  4  9  1  0  0  0  0
  5 10  2  0  0  0  0
  6 11  1  0  0  0  0
  7 12  1  0  0  0  0
  8 13  2  0  0  0  0
  9 14  1  0  0  0  0
 10 15  1  0  0  0  0
 11 15  2  0  0  0  0
 12 16  2  0  0  0  0
 13 16  1  0  0  0  0
 14 17  1  0  0  0  0
 17 18  1  0  0  0  0
 17 19  1  0  0  0  0
 18 20  2  0  0  0  0
 18 21  1  0  0  0  0
 20 22  1  0  0  0  0
 21 23  2  0  0  0  0
 22 24  2  0  0  0  0
 23 24  1  0  0  0  0
M  END
>  <Mol_ID> (101)
4136

>  <Formula> (101)
C23H26ClN

>  <MolWeight> (101)
351.91224

>  <Item Name> (101)
Fendiline hydrochloride

>  <Catalog Number> (101)
S5279

>  <Synonyms> (101)
N/A

>  <Target> (101)
Calcium Channel,Ras

>  <Form> (101)
hydrochloride 

>  <URL> (101)
http://selleckchem.com/products/fendiline-hydrochloride.html

>  <CAS Number> (101)
13636-18-5

$$$$
S5319 AWD 131-138.cdx
csChFnd80/10101813122D

 19 21  0  0  0  0  0  0  0  0999 V2000
    4.8743    6.4159    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    4.4392    7.7452    0.0000 N   0  0  0  0  0  0  0  0  0  0  0  0
    3.0392    7.7452    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    2.6088    6.4117    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    3.7386    5.5908    0.0000 N   0  0  0  0  0  0  0  0  0  0  0  0
    6.2017    5.9859    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
    0.0000    9.8536    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    0.8249    8.7225    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    2.2170    8.8712    0.0000 N   0  0  0  0  0  0  0  0  0  0  0  0
    2.7841   10.1513    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    1.9592   11.2824    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    0.5671   11.1336    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
    3.7386    4.1955    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
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    2.5229    2.0935    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    3.7334    1.3946    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    4.9498    2.0969    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
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  1  2  1  0  0  0  0
  2  3  2  0  0  0  0
  3  4  1  0  0  0  0
  4  5  1  0  0  0  0
  1  5  1  0  0  0  0
  1  6  2  0  0  0  0
  7  8  1  0  0  0  0
  8  9  1  0  0  0  0
  9 10  1  0  0  0  0
 10 11  1  0  0  0  0
 11 12  1  0  0  0  0
  7 12  1  0  0  0  0
  3  9  1  0  0  0  0
 13 14  1  0  0  0  0
 14 15  2  0  0  0  0
 15 16  1  0  0  0  0
 16 17  2  0  0  0  0
 17 18  1  0  0  0  0
 13 18  2  0  0  0  0
 16 19  1  0  0  0  0
  5 13  1  0  0  0  0
M  END
>  <Mol_ID> (102)
4243

>  <Formula> (102)
C13H14ClN3O2

>  <MolWeight> (102)
279.72216

>  <Item Name> (102)
AWD 131-138

>  <Catalog Number> (102)
S5319

>  <Synonyms> (102)
Imepitoin, ELB-138

>  <Target> (102)
Others

>  <Form> (102)
free base

>  <URL> (102)
http://selleckchem.com/products/awd-131-138.html

>  <CAS Number> (102)
188116-07-6

$$$$
S5366 Fipronil.cdx
csChFnd80/10101813122D

 26 27  0  0  0  0  0  0  0  0999 V2000
    4.3103    6.9989    0.0000 N   0  0  0  0  0  0  0  0  0  0  0  0
    4.3103    5.5989    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    3.1797    7.8312    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    5.4326    7.8212    0.0000 N   0  0  0  0  0  0  0  0  0  0  0  0
    3.0909    4.9045    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    5.5142    4.9057    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    3.6105    9.1590    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    1.8470    7.4023    0.0000 N   0  0  0  0  0  0  0  0  0  0  0  0
    4.9906    9.1681    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    3.0781    3.5146    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    1.8785    5.6045    0.0000 Cl  0  0  0  0  0  0  0  0  0  0  0  0
    5.5011    3.4936    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    6.7267    5.6057    0.0000 Cl  0  0  0  0  0  0  0  0  0  0  0  0
    2.7836   10.2888    0.0000 S   0  0  3  0  0  0  0  0  0  0  0  0
    5.8081   10.3046    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    4.2864    2.8000    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    1.3918   10.1376    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    3.3486   11.5697    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
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  1  2  1  0  0  0  0
  1  3  1  0  0  0  0
  1  4  1  0  0  0  0
  2  5  2  0  0  0  0
  2  6  1  0  0  0  0
  3  7  2  0  0  0  0
  3  8  1  0  0  0  0
  4  9  2  0  0  0  0
  5 10  1  0  0  0  0
  5 11  1  0  0  0  0
  6 12  2  0  0  0  0
  6 13  1  0  0  0  0
  7 14  1  0  0  0  0
  7  9  1  0  0  0  0
  9 15  1  0  0  0  0
 10 16  2  0  0  0  0
 12 16  1  0  0  0  0
 14 17  1  0  0  0  0
 14 18  2  0  0  0  0
 15 19  3  0  0  0  0
 16 20  1  0  0  0  0
 17 21  1  0  0  0  0
 17 22  1  0  0  0  0
 17 23  1  0  0  0  0
 20 24  1  0  0  0  0
 20 25  1  0  0  0  0
 20 26  1  0  0  0  0
M  END
>  <Mol_ID> (103)
4250

>  <Formula> (103)
C12H4Cl2F6N4OS

>  <MolWeight> (103)
437.1477792

>  <Item Name> (103)
Fipronil

>  <Catalog Number> (103)
S5366

>  <Synonyms> (103)
Fluocyanobenpyrazole, Termidor

>  <Target> (103)
Anti-infection

>  <Form> (103)
free base

>  <URL> (103)
http://selleckchem.com/products/fipronil.html

>  <CAS Number> (103)
120068-37-3

$$$$
S5514 Lanthanum(III) chloride heptahydrate.cdx
csChFnd80/10101813122D

 11  3  0  0  0  0  0  0  0  0999 V2000
    9.0543    1.4000    0.0000 La  0  0  0  0  0  0  0  0  0  0  0  0
    7.8325    2.0905    0.0000 Cl  0  0  0  0  0  0  0  0  0  0  0  0
   10.2412    2.0650    0.0000 Cl  0  0  0  0  0  0  0  0  0  0  0  0
    9.0543    0.0000    0.0000 Cl  0  0  0  0  0  0  0  0  0  0  0  0
    2.8000   13.1258    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
    1.4000   13.1258    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
    2.1000   11.7258    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
    0.7000   11.7258    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
    3.5000   11.7258    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
    0.0000   13.1258    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
    1.8200   10.3258    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
  1  2  1  0  0  0  0
  1  3  1  0  0  0  0
  1  4  1  0  0  0  0
M  END
>  <Mol_ID> (104)
4324

>  <Formula> (104)
Cl3H14LaO7

>  <MolWeight> (104)
371.37146

>  <Item Name> (104)
Lanthanum(III) chloride heptahydrate

>  <Catalog Number> (104)
S5514

>  <Synonyms> (104)
N/A

>  <Target> (104)
Calcium Channel

>  <Form> (104)
salt

>  <URL> (104)
http://selleckchem.com/products/lanthanum-iii-chloride-heptahydrate.html

>  <CAS Number> (104)
10025-84-0

$$$$
S5543 1, 10-Phenanthroline monohydrate.cdx
csChFnd80/10101813122D

 15 16  0  0  0  0  0  0  0  0999 V2000
    2.7963    2.6209    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    4.1922    2.6209    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    2.0958    3.8343    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    2.0966    1.4091    0.0000 N   0  0  0  0  0  0  0  0  0  0  0  0
    4.8918    3.8326    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    4.8928    1.4075    0.0000 N   0  0  0  0  0  0  0  0  0  0  0  0
    2.7970    5.0488    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    0.6975    3.8343    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    0.6927    1.4091    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    4.1952    5.0392    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    6.2958    3.8326    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    6.2909    1.4075    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    0.0000    2.6262    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    6.9984    2.6156    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    4.2224    0.0000    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
  1  2  1  0  0  0  0
  1  3  2  0  0  0  0
  1  4  1  0  0  0  0
  2  5  2  0  0  0  0
  2  6  1  0  0  0  0
  3  7  1  0  0  0  0
  3  8  1  0  0  0  0
  4  9  2  0  0  0  0
  5 10  1  0  0  0  0
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  7 10  2  0  0  0  0
  8 13  2  0  0  0  0
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 11 14  2  0  0  0  0
 12 14  1  0  0  0  0
M  END
>  <Mol_ID> (105)
4340

>  <Formula> (105)
C12H10N2O

>  <MolWeight> (105)
198.2206

>  <Item Name> (105)
1, 10-Phenanthroline monohydrate

>  <Catalog Number> (105)
S5543

>  <Synonyms> (105)
Phenanthroline monohydrate

>  <Target> (105)
Others

>  <Form> (105)
hydrate 

>  <URL> (105)
http://selleckchem.com/products/1-10-phenanthroline-monohydrate.html

>  <CAS Number> (105)
5144-89-8

$$$$
S5567 Trimethadione.cdx
csChFnd80/10101813122D

 10 10  0  0  0  0  0  0  0  0999 V2000
    1.2124    1.1326    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    1.7819    2.4116    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    2.2528    0.1958    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
    0.3895    0.0000    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    0.0000    1.8326    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    3.1742    2.2652    0.0000 N   0  0  0  0  0  0  0  0  0  0  0  0
    1.0819    3.6240    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
    3.4653    0.8958    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    4.1110    3.3056    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    4.7442    0.3264    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
  1  2  1  0  0  0  0
  1  3  1  0  0  0  0
  1  4  1  0  0  0  0
  1  5  1  0  0  0  0
  2  6  1  0  0  0  0
  2  7  2  0  0  0  0
  3  8  1  0  0  0  0
  6  9  1  0  0  0  0
  6  8  1  0  0  0  0
  8 10  2  0  0  0  0
M  END
>  <Mol_ID> (106)
4355

>  <Formula> (106)
C6H9NO3

>  <MolWeight> (106)
143.14056

>  <Item Name> (106)
Trimethadione

>  <Catalog Number> (106)
S5567

>  <Synonyms> (106)
N/A

>  <Target> (106)
Others

>  <URL> (106)
http://selleckchem.com/products/trimethadione.html

>  <CAS Number> (106)
127-48-0

$$$$
S3935 Nonivamide.cdx
csChFnd80/10101813122D

 21 21  0  0  0  0  0  0  0  0999 V2000
   13.3363    2.1338    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   14.5432    1.4370    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   13.3363    3.5399    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   12.1100    1.4258    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   15.7777    2.1497    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   14.5477    4.2394    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   10.9200    2.1129    0.0000 N   0  0  0  0  0  0  0  0  0  0  0  0
   15.7777    3.5400    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   16.9846    1.4529    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
    9.6965    1.4065    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   16.9861    4.2377    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
   18.1943    2.1514    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    8.4895    2.1033    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    9.6965    0.0000    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
    7.2742    1.4017    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    6.0631    2.1009    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    4.8499    1.4005    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    3.6377    2.1004    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    2.4250    1.4002    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    1.2126    2.1002    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    0.0000    1.4001    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
  1  2  2  0  0  0  0
  1  3  1  0  0  0  0
  1  4  1  0  0  0  0
  2  5  1  0  0  0  0
  3  6  2  0  0  0  0
  4  7  1  0  0  0  0
  5  8  2  0  0  0  0
  5  9  1  0  0  0  0
  6  8  1  0  0  0  0
  7 10  1  0  0  0  0
  8 11  1  0  0  0  0
  9 12  1  0  0  0  0
 10 13  1  0  0  0  0
 10 14  2  0  0  0  0
 13 15  1  0  0  0  0
 15 16  1  0  0  0  0
 16 17  1  0  0  0  0
 17 18  1  0  0  0  0
 18 19  1  0  0  0  0
 19 20  1  0  0  0  0
 20 21  1  0  0  0  0
M  END
>  <Mol_ID> (107)
4402

>  <Formula> (107)
C17H27NO3

>  <MolWeight> (107)
293.40118

>  <Item Name> (107)
Nonivamide

>  <Catalog Number> (107)
S3935

>  <Synonyms> (107)
?Pseudocapsaicin; Pelargonic acid vanillylamide; Nonanoic acid vanillylamide

>  <Target> (107)
TRP Channel

>  <Form> (107)
free base

>  <URL> (107)
http://selleckchem.com/products/.html

>  <CAS Number> (107)
2444-46-4

$$$$
S5247 Selamectin.cdx
csChFnd80/10101813122D

 58 64  0  0  0  0  0  0  0  0999 V2000
   10.8837    4.8670    0.0000 C   0  0  2  0  0  0  0  0  0  0  0  0
    9.6767    4.1772    0.0000 C   0  0  1  0  0  0  0  0  0  0  0  0
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   10.8837    2.0694    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
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   12.1101    4.1772    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   13.3173   10.4430    0.0000 C   0  0  2  0  0  0  0  0  0  0  0  0
   12.1101    2.7784    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    8.0861    2.5868    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
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   14.4861    9.7532    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
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   15.6933   11.8801    0.0000 C   0  0  2  0  0  0  0  0  0  0  0  0
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   13.2981   11.8801    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
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M  END
>  <Mol_ID> (108)
4414

>  <Formula> (108)
C43H63NO11

>  <MolWeight> (108)
769.96042

>  <Item Name> (108)
Selamectin

>  <Catalog Number> (108)
S5247

>  <Synonyms> (108)
N/A

>  <Target> (108)
others

>  <Form> (108)
free base

>  <URL> (108)
http://selleckchem.com/products/.html

>  <CAS Number> (108)
 220119-17-5

$$$$
S5413 Ertugliflozin.cdx
csChFnd80/10101813122D

 30 33  0  0  0  0  0  0  0  0999 V2000
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M  END
>  <Mol_ID> (109)
4437

>  <Formula> (109)
C22H25ClO7

>  <MolWeight> (109)
436.8827

>  <Item Name> (109)
Ertugliflozin

>  <Catalog Number> (109)
S5413

>  <Synonyms> (109)
PF-04971729?

>  <Target> (109)
SGLT2

>  <Form> (109)
free base

>  <URL> (109)
http://selleckchem.com/products/.html

>  <CAS Number> (109)
1210344-57-2

$$$$
S5482 Prilocaine hydrochloride.cdx
csChFnd80/10101813122D

 17 16  0  0  0  0  0  0  0  0999 V2000
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M  END
>  <Mol_ID> (110)
4444

>  <Formula> (110)
C13H21ClN2O

>  <MolWeight> (110)
256.77164

>  <Item Name> (110)
Prilocaine hydrochloride

>  <Catalog Number> (110)
S5482

>  <Synonyms> (110)
N/A

>  <Target> (110)
Sodium channel

>  <Form> (110)
hydrochloride 

>  <URL> (110)
http://selleckchem.com/products/.html

>  <CAS Number> (110)
1786-81-8

$$$$
S5255 Nicardipine.cdx
csChFnd80/10101813122D

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M  END
>  <Mol_ID> (111)
4482

>  <Formula> (111)
C26H29N3O6

>  <MolWeight> (111)
479.52496

>  <Item Name> (111)
Nicardipine

>  <Catalog Number> (111)
S5255

>  <Synonyms> (111)
YC-93

>  <Target> (111)
Others

>  <URL> (111)
http://selleckchem.com/products/.html

>  <CAS Number> (111)
55985-32-5

$$$$
S5371 Ajmaline.cdx
csChFnd80/10101813122D

 29 34  0  0  0  0  0  0  0  0999 V2000
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M  END
>  <Mol_ID> (112)
4916

>  <Formula> (112)
C20H26N2O2

>  <MolWeight> (112)
326.43264

>  <Item Name> (112)
Ajmaline

>  <Catalog Number> (112)
S5371

>  <Target> (112)
"Potassium Channel
Sodium Channel"

>  <Form> (112)
free base

>  <URL> (112)
http://selleckchem.com/products/.html

>  <CAS Number> (112)
4360-12-7

$$$$
S5418 Parecoxib Sodium.cdx
csChFnd80/10101813122D

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 22 24  1  0  0  0  0
 24 25  1  0  0  0  0
  9 26  1  0  0  0  0
 21 27  1  0  0  0  0
M  END
>  <Mol_ID> (113)
4921

>  <Formula> (113)
C19H17N2NaO4S

>  <MolWeight> (113)
392.40405

>  <Item Name> (113)
Parecoxib Sodium

>  <Catalog Number> (113)
S5418

>  <Target> (113)
calcium channel

>  <Form> (113)
free base

>  <URL> (113)
http://selleckchem.com/products/.html

>  <CAS Number> (113)
198470-85-8

$$$$
S5392 Mepivacaine.cdx
csChFnd80/10101813122D

 18 19  0  0  0  0  0  0  0  0999 V2000
    7.2746    2.1000    0.0000 N   0  0  0  0  0  0  0  0  0  0  0  0
    6.0622    2.8000    0.0000 C   0  0  3  0  0  0  0  0  0  0  0  0
    6.0622    4.2000    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    7.2746    4.9000    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    8.4870    4.2000    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    8.4870    2.8000    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    4.8497    2.1000    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    4.8497    0.7000    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
    3.6373    2.8000    0.0000 N   0  0  0  0  0  0  0  0  0  0  0  0
    7.2746    0.7000    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    2.4249    2.1000    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    2.4249    0.7000    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    1.2124    0.0000    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    0.0000    0.7000    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    0.0000    2.1000    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    1.2124    2.8000    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    1.2124    4.2000    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    3.6373    0.0000    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
  1  2  1  0  0  0  0
  2  3  1  0  0  0  0
  3  4  1  0  0  0  0
  4  5  1  0  0  0  0
  5  6  1  0  0  0  0
  1  6  1  0  0  0  0
  7  8  2  0  0  0  0
  7  9  1  0  0  0  0
  2  7  1  0  0  0  0
  1 10  1  0  0  0  0
 11 12  1  0  0  0  0
 12 13  2  0  0  0  0
 13 14  1  0  0  0  0
 14 15  2  0  0  0  0
 15 16  1  0  0  0  0
 11 16  2  0  0  0  0
 16 17  1  0  0  0  0
 12 18  1  0  0  0  0
  9 11  1  0  0  0  0
M  END
>  <Mol_ID> (114)
4946

>  <Formula> (114)
C15H22N2O

>  <MolWeight> (114)
246.34798

>  <Item Name> (114)
Mepivacaine

>  <Catalog Number> (114)
S5392

>  <Target> (114)
Sodium Channel

>  <Form> (114)
free base

>  <URL> (114)
http://selleckchem.com/products/.html

>  <CAS Number> (114)
96-88-8 

$$$$
S5478 Dantrolene sodium.cdx
csChFnd80/10101813122D

 24 25  0  0  0  0  0  0  0  0999 V2000
    6.0763    4.1959    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    4.8664    3.4974    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    7.3513    3.6281    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
    6.2239    5.5899    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    3.6540    4.1974    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    4.8664    2.0879    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    8.2876    4.6677    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    7.5892    5.8774    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    2.4401    3.4966    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    3.6463    1.3834    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    9.6743    4.5179    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    2.4401    2.0889    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   10.5535    5.6036    0.0000 N   0  0  0  0  0  0  0  0  0  0  0  0
    1.2205    1.3848    0.0000 N   0  3  0  0  0  0  0  0  0  0  0  0
   11.9391    5.3792    0.0000 N   0  0  0  0  0  0  0  0  0  0  0  0
    1.2205    0.0000    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
    0.0000    2.0894    0.0000 O   0  5  0  0  0  0  0  0  0  0  0  0
   12.9365    6.3766    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   12.6411    4.1633    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   14.1965    5.7297    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   13.9726    4.3498    0.0000 N   0  0  0  0  0  0  0  0  0  0  0  0
   11.9178    2.9106    0.0000 O   0  5  0  0  0  0  0  0  0  0  0  0
   15.4429    6.3608    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
    9.7285    2.8608    0.0000 Na  0  3  0  0  0  0  0  0  0  0  0  0
  1  2  1  0  0  0  0
  1  3  1  0  0  0  0
  1  4  2  0  0  0  0
  2  5  1  0  0  0  0
  2  6  2  0  0  0  0
  3  7  1  0  0  0  0
  4  8  1  0  0  0  0
  5  9  2  0  0  0  0
  6 10  1  0  0  0  0
  7 11  1  0  0  0  0
  7  8  2  0  0  0  0
  9 12  1  0  0  0  0
 10 12  2  0  0  0  0
 11 13  2  0  0  0  0
 12 14  1  0  0  0  0
 13 15  1  0  0  0  0
 14 16  2  0  0  0  0
 14 17  1  0  0  0  0
 15 18  1  0  0  0  0
 15 19  1  0  0  0  0
 18 20  1  0  0  0  0
 19 21  2  0  0  0  0
 19 22  1  0  0  0  0
 20 23  2  0  0  0  0
 20 21  1  0  0  0  0
M  END
>  <Mol_ID> (115)
4990

>  <Formula> (115)
C14H9N4NaO5

>  <MolWeight> (115)
336.23483

>  <Item Name> (115)
Dantrolene sodium

>  <Catalog Number> (115)
S5478

>  <Synonyms> (115)
"sodium;3-[(E)-[5-(4-nitrophenyl)furan-2-yl]methylideneamino]-5-oxo-4H-imidazol-2-olate
DANTROLENE SO

>  <Target> (115)
calcium channel

>  <Form> (115)
free base

>  <URL> (115)
http://selleckchem.com/products/.html

>  <CAS Number> (115)
14663-23-1

$$$$
S5504 Ropivacaine.cdx
csChFnd80/10101813122D

 20 21  0  0  0  0  0  0  0  0999 V2000
    6.0496    2.1002    0.0000 C   0  0  2  0  0  0  0  0  0  0  0  0
    7.2621    2.8002    0.0000 N   0  0  0  0  0  0  0  0  0  0  0  0
    4.8414    2.7977    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    6.0496    0.7002    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    8.4746    2.1002    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    7.2621    4.1953    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    3.6332    2.1002    0.0000 N   0  0  0  0  0  0  0  0  0  0  0  0
    4.8414    4.1929    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
    7.2621    0.0000    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    8.4746    0.7002    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    8.4703    4.8929    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    2.4250    2.7977    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    8.4703    6.2880    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    1.2125    2.0977    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    2.4250    4.1978    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    0.0000    2.7977    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    1.2125    0.7026    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    1.2125    4.8977    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    0.0000    4.1977    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    3.6332    4.8953    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
  1  2  1  0  0  0  0
  1  3  1  1  0  0  0
  1  4  1  0  0  0  0
  2  5  1  0  0  0  0
  2  6  1  0  0  0  0
  3  7  1  0  0  0  0
  3  8  2  0  0  0  0
  4  9  1  0  0  0  0
  5 10  1  0  0  0  0
  6 11  1  0  0  0  0
  7 12  1  0  0  0  0
  9 10  1  0  0  0  0
 11 13  1  0  0  0  0
 12 14  2  0  0  0  0
 12 15  1  0  0  0  0
 14 16  1  0  0  0  0
 14 17  1  0  0  0  0
 15 18  2  0  0  0  0
 15 20  1  0  0  0  0
 16 19  2  0  0  0  0
 18 19  1  0  0  0  0
M  END
>  <Mol_ID> (116)
4992

>  <Formula> (116)
C17H26N2O

>  <MolWeight> (116)
274.40114

>  <Item Name> (116)
Ropivacaine

>  <Catalog Number> (116)
S5504

>  <Target> (116)
Potassium Channel

>  <URL> (116)
http://selleckchem.com/products/.html

>  <CAS Number> (116)
84057-95-4

$$$$
