CFam Chemical Families Database
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You are searching for "CFAMM00311021" in compound.

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CFAM Mol ID CFAMM00311021
Family CFFBM393 Xanthine dehydrogenase/oxidase inhibitor AGN-PC-06VJIZ family
Superfamily CFSBM249 Prelamin-A/C and Muscleblind-like protein 1 Binder Superfamily
Class CFCBM92 Class 3142
External ID CHEMBL409557 External Source CHEMBL
PubChem CID 3071206 Functional Category Bioactive
Molecule Name BRN 6447192
IUPAC Name 3-(4-chloro-3-nitrophenyl)-6-pyrrolidin-1-yl-[1,2,4]triazolo[3,4-a]phthalazine
Synonyms 1,2,4-Triazolo(3,4-a)phthalazine, 3-(4-chloro-3-nitrophenyl)-6-(1-pyrrolidinyl)-;3-(4-Chloro-3-nitrophenyl)-6-(1-pyrrolidinyl)-1,2,4-triazolo(3,4-a)phthalazine;87540-12-3;AC1MIJW8;CTK5F8608;CHEBI:113424;AG-H-53300;LS-156578;3-(4-CHLORO-3-NITROPHENYL)-6-(PYRROLIDIN-1-YL)-1,2,4-TRIAZOLO[3,4-A]PHTHALAZINE
InChi InChI=1S/C19H15ClN6O2/c20-15-8-7-12(11-16(15)26(27)28)17-21-22-18-13-5-1-2-6-14(13)19(23-25(17)18)24-9-3-4-10-24/h1-2,5-8,11H,3-4,9-10H2
InChiKey PQUZJMDHHOCOHZ-UHFFFAOYSA-N
Formula C19H15ClN6O2 Molecular Weight 394.81
Cross Link CHEMBL409557
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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