CFam Chemical Families Database
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You are searching for "CFAMM00421268" in compound.

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CFAM Mol ID CFAMM00421268
Family CFFBM13239 Gonadotropin-releasing hormone receptor ligand SureCN7899418 family
Superfamily CFSBM485 Gonadotropin-releasing hormone receptor and Beta-lactamase Binder Superfamily
Class CFCAD173 Class 173
External ID CHEMBL297430 External Source CHEMBL
PubChem CID 44293178 Functional Category Bioactive
Molecule Name AGN-PC-073QBV
IUPAC Name 2-[2-(3,5-dimethylphenyl)-3-[2-[4-[4-(methanesulfonamido)phenyl]butylamino]ethyl]-1H-indol-5-yl]-2-methyl-N,N-dipropylpropanamide
Synonyms CHEBI:172465;2-[2-(3,5-dimethylphenyl)-3-[2-[4-[4-(methanesulfonamido)phenyl]butylamino]ethyl]-1H-indol-5-yl]-2-methyl-N,N-dipropylpropanamide
InChi InChI=1S/C39H54N4O3S/c1-8-22-43(23-9-2)38(44)39(5,6)32-15-18-36-35(27-32)34(37(41-36)31-25-28(3)24-29(4)26-31)19-21-40-20-11-10-12-30-13-16-33(17-14-30)42-47(7,45)46/h13-18,24-27,40-42H,8-12,19-23H2,1-7H3
InChiKey HPINLEOMRRRQAD-UHFFFAOYSA-N
Formula C39H54N4O3S Molecular Weight 658.94
Cross Link CHEMBL297430
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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