CFam Chemical Families Database
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You are searching for "CFAMM00359121" in compound.

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CFAM Mol ID CFAMM00359121
Family CFFBM4813 Reverse transcriptase/RNaseH inhibitor Dipyridodiazepinone deriv. 61 family
Superfamily CFSCD587 Smoothened homolog Inhibitor LDE225 Superfamily
Class CFCCD350 Class 1163
External ID CHEMBL147800 External Source CHEMBL
PubChem CID 464546 Functional Category Bioactive
Molecule Name Nevirapin 4-substituted deriv. 4aa
IUPAC Name 11-cyclopropyl-4-[(2-hydroxyphenyl)methyl]-5H-dipyrido[2,3-e:2',3'-f][1,4]diazepin-6-one
Synonyms AC1LA9ZT;11-Cyclopropyl-5,11-dihydro-4-[(2-hydroxyphenyl)methyl]-6H-dipyrido[3,2-b:2',3'-e][1,4]diazepin-6-one
InChi InChI=1S/C21H18N4O2/c26-17-6-2-1-4-13(17)12-14-9-11-23-20-18(14)24-21(27)16-5-3-10-22-19(16)25(20)15-7-8-15/h1-6,9-11,15,26H,7-8,12H2,(H,24,27)
InChiKey SNEUVPRZHPSNON-UHFFFAOYSA-N
Formula C21H18N4O2 Molecular Weight 358.39
Cross Link CHEMBL147800
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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Deputy Director of Center for Computational Science and Engineering
Professor in Department of Pharmacy
National University of Singapore, Singapore


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