CFam Chemical Families Database
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You are searching for "CFAMM00383536" in compound.

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CFAM Mol ID CFAMM00383536
Family CFFBM7839 Cytochrome P450 26A1 and Cytochrome P450 3A4 inhibitor AGN-PC-0A9QR8 family
Superfamily CFSCD667 Steroid 17-alpha-hydroxylase/17,20 lyase Inhibitor TAK-700 Superfamily
Class CFCAD307 Class 307
External ID CHEMBL1766000 External Source CHEMBL
PubChem CID 52951448 Functional Category Bioactive
Molecule Name AGN-PC-09MAW3
IUPAC Name methyl 3-(4-anilinophenyl)-3-imidazol-1-yl-2,2-dimethylpropanoate
Synonyms CHEBI:1241029;methyl 3-(4-anilinophenyl)-3-imidazol-1-yl-2,2-dimethylpropanoate
InChi InChI=1S/C21H23N3O2/c1-21(2,20(25)26-3)19(24-14-13-22-15-24)16-9-11-18(12-10-16)23-17-7-5-4-6-8-17/h4-15,19,23H,1-3H3
InChiKey XJNXEEASXBUDAQ-UHFFFAOYSA-N
Formula C21H23N3O2 Molecular Weight 349.43
Cross Link CHEMBL1766000
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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