CFam Chemical Families Database
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You are searching for "CFAMM00397982" in compound.

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CFAM Mol ID CFAMM00397982
Family CFFBM9778 CGMP-dependent protein kinase inhibitor AGN-PC-075XJ0 family
Superfamily CFSID453 Gp29 Inhibitor Tmpyp4 Superfamily
Class CFCID316 Class 1666
External ID CHEMBL371306 External Source CHEMBL
PubChem CID 44404378 Functional Category Bioactive
Molecule Name AGN-PC-075XJ3
IUPAC Name 1-[4-[5-(4-fluorophenyl)-4-pyridin-4-yl-1H-pyrrol-2-yl]piperidin-1-yl]-3-propan-2-yloxypropan-2-ol
Synonyms CHEBI:430249;1-[4-[5-(4-fluorophenyl)-4-pyridin-4-yl-1H-pyrrol-2-yl]piperidin-1-yl]-3-propan-2-yloxypropan-2-ol
InChi InChI=1S/C26H32FN3O2/c1-18(2)32-17-23(31)16-30-13-9-20(10-14-30)25-15-24(19-7-11-28-12-8-19)26(29-25)21-3-5-22(27)6-4-21/h3-8,11-12,15,18,20,23,29,31H,9-10,13-14,16-17H2,1-2H3
InChiKey KEUKMNZDHGINNL-UHFFFAOYSA-N
Formula C26H32FN3O2 Molecular Weight 437.55
Cross Link CHEMBL371306
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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