CFam Chemical Families Database
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You are searching for "CFAMM00301673" in compound.

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Click on CFAM IDs and names to search or view in CFAM, click on external IDs to view the entity in its source database.

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CFAM Mol ID CFAMM00301673
Family CFFID4038 Sodium-dependent dopamine transporter Inhibitor (+/-)-threo-n-(3-methylthiopene)methylphenidate Family
Superfamily CFSID2737 Sodium-dependent dopamine transporter Inhibitor (+/-)-threo-n-(3-methylthiopene)methylphenidate Superfamily
Class CFCID1624 Class 2974
External ID CHEMBL180918 External Source CHEMBL
PubChem CID 44389368 Functional Category Bioactive
Molecule Name AGN-PC-075C5X
IUPAC Name methyl 3-[4-(5-bromothiophen-2-yl)phenyl]-8-methyl-8-azabicyclo[3.2.1]octane-4-carboxylate
Synonyms CHEBI:400726;methyl 3-[4-(5-bromothiophen-2-yl)phenyl]-8-methyl-8-azabicyclo[3.2.1]octane-4-carboxylate
InChi InChI=1S/C20H22BrNO2S/c1-22-14-7-8-16(22)19(20(23)24-2)15(11-14)12-3-5-13(6-4-12)17-9-10-18(21)25-17/h3-6,9-10,14-16,19H,7-8,11H2,1-2H3
Formula C20H22BrNO2S Molecular Weight 420.36
Cross Link CHEMBL180918

Statistics of CFAM Database

CFAM currently contains 490,279 molecules in 87,136 families, 34,880 superfamilies and 11,643 classes.

How to cite our database

C. Zhang, L. Tao, C. Qin, P. Zhang, S.Y. Chen, X. Zeng, F. Xu, Z. Chen, S.Y. Yang and Y.Z. CFam: A Chemical Families Database Based on Iterative Selection of Functional Seeds and Seed-Directed Compound Clustering. Nucl. Acids Res. 43 (D1): D558-D565 (2015) (First published online: November 20, 2014).

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