CFam Chemical Families Database
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You are searching for "CFAMM00068085" in compound.

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CFAM Mol ID CFAMM00068085
Family CFFAD464 Peptide deformylase, mitochondrial Inhibitor Pyrimethamine Family
Superfamily CFSAD403 Peptide deformylase, mitochondrial Inhibitor Pyrimethamine Superfamily
Class CFCAD375 Class 375
External ID CHEMBL293822 External Source CHEMBL
PubChem CID 456235 Functional Category Bioactive
Molecule Name AC1L9UIU
IUPAC Name 5-[4-chloro-3-[[methyl(propyl)amino]diazenyl]phenyl]-6-ethylpyrimidine-2,4-diamine;methanesulfonic acid
Synonyms CHEBI:187229;5-[4-chloro-3-[[methyl(propyl)amino]diazenyl]phenyl]-6-ethylpyrimidine-2,4-diamine; methanesulfonic acid;Methanesulphonic acid salt of 2,4-Diamino-5-[4-chloro-3-(3-methyl-3-propyltriazen-1-yl)phenyl]-6-ethylpyrimidine
InChi InChI=1S/C16H22ClN7.CH4O3S/c1-4-8-24(3)23-22-13-9-10(6-7-11(13)17)14-12(5-2)20-16(19)21-15(14)18;1-5(2,3)4/h6-7,9H,4-5,8H2,1-3H3,(H4,18,19,20,21);1H3,(H,2,3,4)/b23-22+;
InChiKey FPWPWCMGMXJOFM-PGCQSHBKSA-N
Formula C16H22ClN7.CH4O3S Molecular Weight 443.95
Cross Link CHEMBL293822
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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