CFam Chemical Families Database
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You are searching for "CFAMM00406658" 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 CFAMM00406658
Family CFFBM11079 Melanin-concentrating hormone receptor 1 ligand AGN-PC-00BSP9 family
Superfamily CFSBM853 Progesterone receptor and D(2) dopamine receptor Binder Superfamily 2
Class CFCAD667 Class 667
External ID CHEMBL209993 External Source CHEMBL
PubChem CID 11698592 Functional Category Bioactive
Molecule Name AGN-PC-00ED2X
IUPAC Name 3-[4-[[5-fluoro-6-(trifluoromethyl)-1H-benzimidazol-2-yl]-piperidin-4-ylidenemethyl]phenyl]benzonitrile
Synonyms SureCN14502039;CHEBI:452023;3-[4-[[5-fluoro-6-(trifluoromethyl)-1H-benzimidazol-2-yl]-piperidin-4-ylidenemethyl]phenyl]benzonitrile
InChi InChI=1S/C27H20F4N4/c28-22-14-24-23(13-21(22)27(29,30)31)34-26(35-24)25(19-8-10-33-11-9-19)18-6-4-17(5-7-18)20-3-1-2-16(12-20)15-32/h1-7,12-14,33H,8-11H2,(H,34,35)
InChiKey QZSGUXROLZTHQT-UHFFFAOYSA-N
Formula C27H20F4N4 Molecular Weight 476.47
Cross Link CHEMBL209993
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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