CFam Chemical Families Database
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You are searching for "CFAMM00425385" in compound.

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CFAM Mol ID CFAMM00425385
Family CFFBM13967 Kinesin-like protein KIF11 and Potassium voltage-gated channel subfamily H member 2 ligand 1-[(3R,3aR)-3-[3-(dimethylamino)propyl]-8-fluoro-3-phenyl-3a,4-dihydropyrazolo[5,1-c][1,4]benzoxazin-2-yl]ethanone family
Superfamily CFSBM6213 Kinesin-like protein KIF11 and Potassium voltage-gated channel subfamily H member 2 Binder Superfamily 2
Class CFCAD217 Class 217
External ID CHEMBL249883 External Source CHEMBL
PubChem CID 44442302 Functional Category Bioactive
Molecule Name 1-[(3R,3aR)-3-phenyl-3a,4-dihydro-3H-pyrazolo[5,1-c][1,4]benzoxazin-2-yl]ethanone
IUPAC Name 1-[(3R,3aR)-3-phenyl-3a,4-dihydro-3H-pyrazolo[5,1-c][1,4]benzoxazin-2-yl]ethanone
Synonyms CHEBI:514315
InChi InChI=1S/C18H16N2O2/c1-12(21)18-17(13-7-3-2-4-8-13)15-11-22-16-10-6-5-9-14(16)20(15)19-18/h2-10,15,17H,11H2,1H3/t15-,17+/m0/s1
InChiKey PWLVXDLIYFIZBL-DOTOQJQBSA-N
Formula C18H16N2O2 Molecular Weight 292.33
Cross Link CHEMBL249883
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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