CFam Chemical Families Database
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You are searching for "CFAMM00450046" in compound.

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CFAM Mol ID CFAMM00450046
Family CFFBM18964 cAMP-specific 3',5'-cyclic phosphodiesterase 4D inhibitor (4aS,8aR)-4-(3,4-dimethoxyphenyl)-2-[[4-(morpholin-4-ylmethyl)phenyl]methyl]-4a,5,8,8a-tetrahydrophthalazin-1-one;hydrochloride family
Superfamily CFSBM3461 cAMP-specific 3',5'-cyclic phosphodiesterase 4B and cAMP-specific 3',5'-cyclic phosphodiesterase 4D Binder Superfamily
Class CFCCD115 Class 928
External ID CHEMBL593656 External Source CHEMBL
PubChem CID 46227215 Functional Category Bioactive
Molecule Name (4aS,8aR)-4-(3,4-dimethoxyphenyl)-2-[[4-(morpholin-4-ylmethyl)phenyl]methyl]-4a,5,8,8a-tetrahydrophthalazin-1-one;hydrochloride
IUPAC Name (4aS,8aR)-4-(3,4-dimethoxyphenyl)-2-[[4-(morpholin-4-ylmethyl)phenyl]methyl]-4a,5,8,8a-tetrahydrophthalazin-1-one;hydrochloride
Synonyms CHEBI:694308
InChi InChI=1S/C28H33N3O4.ClH/c1-33-25-12-11-22(17-26(25)34-2)27-23-5-3-4-6-24(23)28(32)31(29-27)19-21-9-7-20(8-10-21)18-30-13-15-35-16-14-30;/h3-4,7-12,17,23-24H,5-6,13-16,18-19H2,1-2H3;1H/t23-,24+;/m0./s1
InChiKey WDWRDERIERMNKE-KZDWWKKTSA-N
Formula C28H34ClN3O4 Molecular Weight 512.04
Cross Link CHEMBL593656
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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