CFam Chemical Families Database
BIDD Pharmainformatics Databases
 
   
You are searching for "CFAMM00217309" in compound.

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CFAM Mol ID CFAMM00217309
Family CFFID705 Enoyl-[acyl-carrier-protein] reductase [NADH] Inhibitor N-(4-methylbenzoyl)-4-benzylpiperidine Family
Superfamily CFSID578 Enoyl-[acyl-carrier-protein] reductase [NADH] Inhibitor N-(4-methylbenzoyl)-4-benzylpiperidine Superfamily
Class CFCCD502 Class 1315
External ID ZINC62001419 External Source ZINC
PubChem CID 24017417 Functional Category Natural Product
Molecule Name 2-methyl-4-(1,2,3,4-tetrahydroisoquinoline-2-carbonyl)isoquinolin-1(2H)-one
IUPAC Name 4-(3,4-dihydro-1H-isoquinoline-2-carbonyl)-2-methylisoquinolin-1-one
Synonyms Oprea1_023701;MolPort-009-758-844;ZINC62001419;MCULE-7438643470;4-(3,4-dihydro-1H-isoquinoline-2-carbonyl)-2-methylisoquinolin-1-one
InChi InChI=1S/C20H18N2O2/c1-21-13-18(16-8-4-5-9-17(16)19(21)23)20(24)22-11-10-14-6-2-3-7-15(14)12-22/h2-9,13H,10-12H2,1H3
InChiKey CLPIXQVVDLSDSG-UHFFFAOYSA-N
Formula C20H18N2O2 Molecular Weight 318.37
Cross Link
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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