CFam Chemical Families Database
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You are searching for "CFAMM00322975" in compound.

Total 1 results found.

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 CFAMM00322975
Family CFFBM1398 Sodium-dependent serotonin transporter and Sodium-dependent dopamine transporter inhibitor AGN-PC-075C5X family
Superfamily CFSBM797 Sodium-dependent serotonin transporter and Transporter Binder Superfamily 3
Class CFCID1498 Class 2848
External ID CHEMBL578419 External Source CHEMBL
PubChem CID 45481792 Functional Category Bioactive
Molecule Name methyl (3S,4S)-3-(3-bromo-4-methylsulfanylphenyl)-8-methyl-8-azabicyclo[3.2.1]octane-4-carboxylate
IUPAC Name methyl (3S,4S)-3-(3-bromo-4-methylsulfanylphenyl)-8-methyl-8-azabicyclo[3.2.1]octane-4-carboxylate
Synonyms CHEBI:669065
InChi InChI=1S/C17H22BrNO2S/c1-19-11-5-6-14(19)16(17(20)21-2)12(9-11)10-4-7-15(22-3)13(18)8-10/h4,7-8,11-12,14,16H,5-6,9H2,1-3H3/t11?,12-,14?,16+/m1/s1
InChiKey NNQDGWJXUJCRBF-MENKECLHSA-N
Formula C17H22BrNO2S Molecular Weight 384.33
Cross Link CHEMBL578419
Structure

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).
 

Last update by

 
2014.08.29
 

 

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Dr. Chen Yuzong

Deputy Director of Center for Computational Science and Engineering
Professor in Department of Pharmacy
National University of Singapore, Singapore


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