CFam Chemical Families Database
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You are searching for "CFAMM00418751" in compound.

Total 1 results found.

Click on CFAM IDs and names to search or view in CFAM, click on external IDs to view the entity in its source database.

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CFAM Mol ID CFAMM00418751
Family CFFBM12883 Dipeptidyl peptidase 4 and Cytochrome P450 2D6 inhibitor (3R)-3-amino-1-[(2S)-2-[(pyrimidin-2-ylamino)methyl]pyrrolidin-1-yl]-4-(2,4,5-trifluorophenyl)butan-1-one family
Superfamily CFSCD638 Histone deacetylase 6 Inhibitor ACY-1215 Superfamily
Class CFCAD144 Class 144
External ID CHEMBL90424 External Source CHEMBL
PubChem CID 10270194 Functional Category Bioactive
Molecule Name SureCN4856424
IUPAC Name 7-[2-(cyclopropylmethylamino)pyrimidin-4-yl]-6-(4-fluorophenyl)-2,3-dihydro-1H-pyrazolo[1,2-a]pyrazol-5-one
Synonyms CHEBI:249590
InChi InChI=1S/C20H20FN5O/c21-15-6-4-14(5-7-15)17-18(25-10-1-11-26(25)19(17)27)16-8-9-22-20(24-16)23-12-13-2-3-13/h4-9,13H,1-3,10-12H2,(H,22,23,24)
InChiKey DIHFVAMILQNPTN-UHFFFAOYSA-N
Formula C20H20FN5O Molecular Weight 365.40
Cross Link CHEMBL90424
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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