CFam Chemical Families Database
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You are searching for "CFAMM00412440" in compound.

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CFAM Mol ID CFAMM00412440
Family CFFBM11889 cAMP and cAMP-inhibited cGMP 3',5'-cyclic phosphodiesterase 10A inhibitor 1-pyridin-4-yl-3-(2-quinolin-4-ylpyrazol-3-yl)pyridazin-4-one family
Superfamily CFSBM5605 cAMP and cAMP-inhibited cGMP 3',5'-cyclic phosphodiesterase 10A Binder Superfamily 6
Class CFCCD219 Class 1032
External ID CHEMBL2180794 External Source CHEMBL
PubChem CID 59453408 Functional Category Bioactive
Molecule Name 3-[2-(3-chlorophenyl)pyrazol-3-yl]-1-quinolin-6-ylpyridazin-4-one
IUPAC Name 3-[2-(3-chlorophenyl)pyrazol-3-yl]-1-quinolin-6-ylpyridazin-4-one
Synonyms AGN-PC-0CX73Z;SureCN3504710;3-[2-(3-chlorophenyl)pyrazol-3-yl]-1-quinolin-6-ylpyridazin-4-one
InChi InChI=1S/C22H14ClN5O/c23-16-4-1-5-18(14-16)28-20(8-11-25-28)22-21(29)9-12-27(26-22)17-6-7-19-15(13-17)3-2-10-24-19/h1-14H
InChiKey XTWQWVGEILJQIM-UHFFFAOYSA-N
Formula C22H14ClN5O Molecular Weight 399.83
Cross Link CHEMBL2180794
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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