CFam Chemical Families Database
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You are searching for "CFAMM00390922" 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 CFAMM00390922
Family CFFBM8832 Platelet-derived growth factor receptor beta ligand AGN-PC-075FQH family
Superfamily CFSBM4656 5-hydroxytryptamine receptor 1A and Sodium-dependent serotonin transporter Binder Superfamily 5
Class CFCCD125 Class 938
External ID CHEMBL186719 External Source CHEMBL
PubChem CID 44394679 Functional Category Bioactive
Molecule Name AGN-PC-075FRN
IUPAC Name 4-[3-cyano-6-methoxy-7-(3-piperidin-1-ylpropoxy)quinolin-4-yl]-N-(4-cyanophenyl)piperazine-1-carbothioamide
Synonyms CHEBI:409377;4-[3-cyano-6-methoxy-7-(3-piperidin-1-ylpropoxy)quinolin-4-yl]-N-(4-cyanophenyl)piperazine-1-carbothioamide
InChi InChI=1S/C31H35N7O2S/c1-39-28-18-26-27(19-29(28)40-17-5-12-36-10-3-2-4-11-36)34-22-24(21-33)30(26)37-13-15-38(16-14-37)31(41)35-25-8-6-23(20-32)7-9-25/h6-9,18-19,22H,2-5,10-17H2,1H3,(H,35,41)
InChiKey ZJOHAEZPXFNGLV-UHFFFAOYSA-N
Formula C31H35N7O2S Molecular Weight 569.72
Cross Link CHEMBL186719
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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