CFam Chemical Families Database
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You are searching for "CFAMM00313884" in compound.

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CFAM Mol ID CFAMM00313884
Family CFFBM628 Smoothened homolog inhibitor SureCN1090957 family
Superfamily CFSID1360 Vascular endothelial growth factor receptor 2 Ligand 4-(4-p-tolylamino-phthalazin-1-yl)-benzamide Superfamily
Class CFCCD339 Class 1152
External ID CHEMBL1084734 External Source CHEMBL
PubChem CID 46891248 Functional Category Bioactive
Molecule Name SureCN1090957
IUPAC Name [(3R)-4-[4-[4-(hydroxymethyl)phenyl]phthalazin-1-yl]-3-methylpiperazin-1-yl]-phenylmethanone
Synonyms CHEBI:733409
InChi InChI=1S/C27H26N4O2/c1-19-17-30(27(33)22-7-3-2-4-8-22)15-16-31(19)26-24-10-6-5-9-23(24)25(28-29-26)21-13-11-20(18-32)12-14-21/h2-14,19,32H,15-18H2,1H3/t19-/m1/s1
InChiKey DRVZFOGEZROJQL-LJQANCHMSA-N
Formula C27H26N4O2 Molecular Weight 438.52
Cross Link CHEMBL1084734
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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