CFam Chemical Families Database
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You are searching for "CFAMM00396654" in compound.

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CFAM Mol ID CFAMM00396654
Family CFFBM9587 Integrase inhibitor (Z)-4-[5-chloro-1-[(4-fluorophenyl)methyl]indol-3-yl]-4-hydroxy-2-oxobut-3-enoic acid family
Superfamily CFSBM4894 Integrase and Reverse transcriptase/RNaseH Binder Superfamily
Class CFCBM645 Class 3695
External ID CHEMBL363333 External Source CHEMBL
PubChem CID 5743057 Functional Category Bioactive
Molecule Name AC1NX431
IUPAC Name (Z)-4-(1-benzylindol-2-yl)-4-hydroxy-2-oxobut-3-enoic acid
Synonyms CHEMBL2262610;CHEBI:413435;(Z)-4-(1-benzylindol-2-yl)-4-hydroxy-2-oxobut-3-enoic acid;2-Butenoic acid, 2-hydroxy-4-(1-benzyl-1H-indol-2-yl)-4-oxo-, (2Z)-
InChi InChI=1S/C19H15NO4/c21-17(11-18(22)19(23)24)16-10-14-8-4-5-9-15(14)20(16)12-13-6-2-1-3-7-13/h1-11,21H,12H2,(H,23,24)/b17-11-
InChiKey JWMOMKKBIXFXMQ-BOPFTXTBSA-N
Formula C19H15NO4 Molecular Weight 321.33
Cross Link CHEMBL2262610
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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