CFam Chemical Families Database
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You are searching for "CFAMM00424346" in compound.

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CFAM Mol ID CFAMM00424346
Family CFFBM13804 Histone deacetylase 1 inhibitor 1-methyl-N-[(1S)-7-oxo-1-(5-quinoxalin-2-yl-1H-imidazol-2-yl)nonyl]azetidine-3-carboxamide family
Superfamily CFSBM6168 Histone deacetylase 1 inhibitor 1-methyl-N-[(1S)-7-oxo-1-(5-quinoxalin-2-yl-1H-imidazol-2-yl)nonyl]azetidine-3-carboxamide Superfamily
Class CFCID301 Class 1651
External ID CHEMBL2448576 External Source CHEMBL
PubChem CID 11556677 Functional Category Bioactive
Molecule Name SureCN2073575
IUPAC Name N-[(1S)-1-[5-(2-methoxyquinolin-3-yl)-1H-imidazol-2-yl]-7-oxononyl]-1-methylazetidine-3-carboxamide
Synonyms KB-70449;3-Azetidinecarboxamide,N-[(1S)-1-[5-(2-methoxy-3-quinolinyl)-1H-imidazol-2-yl]-7-oxononyl]-1-methyl-;891264-65-6
InChi InChI=1S/C27H35N5O3/c1-4-20(33)11-6-5-7-13-23(30-26(34)19-16-32(2)17-19)25-28-15-24(29-25)21-14-18-10-8-9-12-22(18)31-27(21)35-3/h8-10,12,14-15,19,23H,4-7,11,13,16-17H2,1-3H3,(H,28,29)(H,30,34)/t23-/m0/s1
InChiKey AWTXQEUYEIEIGL-QHCPKHFHSA-N
Formula C27H35N5O3 Molecular Weight 477.60
Cross Link CHEMBL2448576
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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