CFam Chemical Families Database
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You are searching for "CFAMM00443495" in compound.

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CFAM Mol ID CFAMM00443495
Family CFFBM17591 cGMP-specific 3',5'-cyclic phosphodiesterase inhibitor 7-chloro-N-[(3-chloro-4-methoxyphenyl)methyl]-6-nitroquinazolin-4-amine family
Superfamily CFSBM3769 Epidermal growth factor receptor and Receptor tyrosine-protein kinase erbB-2 Binder Superfamily
Class CFCID1605 Class 2955
External ID CHEMBL524871 External Source CHEMBL
PubChem CID 44562858 Functional Category Bioactive
Molecule Name 4-N-[(3-chloro-4-methoxyphenyl)methyl]-7-N,7-N-dimethyl-6-nitroquinazoline-4,7-diamine
IUPAC Name 4-N-[(3-chloro-4-methoxyphenyl)methyl]-7-N,7-N-dimethyl-6-nitroquinazoline-4,7-diamine
Synonyms AGN-PC-078W91;CHEBI:552661;4-N-[(3-chloro-4-methoxyphenyl)methyl]-7-N,7-N-dimethyl-6-nitroquinazoline-4,7-diamine
InChi InChI=1S/C18H18ClN5O3/c1-23(2)15-8-14-12(7-16(15)24(25)26)18(22-10-21-14)20-9-11-4-5-17(27-3)13(19)6-11/h4-8,10H,9H2,1-3H3,(H,20,21,22)
InChiKey UGUQXDRMBVVENM-UHFFFAOYSA-N
Formula C18H18ClN5O3 Molecular Weight 387.82
Cross Link CHEMBL524871
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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