CFam Chemical Families Database
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You are searching for "CFAMM00342188" in compound.

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CFAM Mol ID CFAMM00342188
Family CFFBM2999 cGMP-specific 3',5'-cyclic phosphodiesterase inhibitor SureCN6412773 family
Superfamily CFSBM1689 Dual specificity protein kinase CLK4 and cAMP Binder Superfamily
Class CFCAD377 Class 377
External ID CHEMBL1744059 External Source CHEMBL
PubChem CID 9892886 Functional Category Bioactive
Molecule Name (3R)-3-(1,3-benzodioxol-5-yl)-2-[5-(3,4-dimethoxyphenyl)pyrimidin-2-yl]-3,4-dihydro-1H-pyrrolo[3,4-b]quinolin-9-one
IUPAC Name (3R)-3-(1,3-benzodioxol-5-yl)-2-[5-(3,4-dimethoxyphenyl)pyrimidin-2-yl]-3,4-dihydro-1H-pyrrolo[3,4-b]quinolin-9-one
Synonyms SureCN6406296;LS-139702
InChi InChI=1S/C30H24N4O5/c1-36-23-9-7-17(11-25(23)37-2)19-13-31-30(32-14-19)34-15-21-27(33-22-6-4-3-5-20(22)29(21)35)28(34)18-8-10-24-26(12-18)39-16-38-24/h3-14,28H,15-16H2,1-2H3,(H,33,35)/t28-/m1/s1
InChiKey UKTMVBPQNHUHGD-MUUNZHRXSA-N
Formula C30H24N4O5 Molecular Weight 520.54
Cross Link CHEMBL1744059
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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