CFam Chemical Families Database
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You are searching for "CFAMM00377395" in compound.

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CFAM Mol ID CFAMM00377395
Family CFFBM7132 Dipeptidyl peptidase 4 inhibitor 3-[6-[(3R,4S)-3-amino-4-(2,4,5-trifluorophenyl)pyrrolidin-1-yl]pyrimidin-4-yl]benzoic acid family
Superfamily CFSBM3031 Dihydrofolate reductase and Egl nine homolog 1 Binder Superfamily
Class CFCCD440 Class 1253
External ID CHEMBL391252 External Source CHEMBL
PubChem CID 44433233 Functional Category Bioactive
Molecule Name [3-[6-[(3R,4S)-3-amino-4-(2,4,5-trifluorophenyl)pyrrolidin-1-yl]pyrimidin-4-yl]phenyl]methanol
IUPAC Name [3-[6-[(3R,4S)-3-amino-4-(2,4,5-trifluorophenyl)pyrrolidin-1-yl]pyrimidin-4-yl]phenyl]methanol
Synonyms CHEBI:498417
InChi InChI=1S/C21H19F3N4O/c22-16-6-18(24)17(23)5-14(16)15-8-28(9-19(15)25)21-7-20(26-11-27-21)13-3-1-2-12(4-13)10-29/h1-7,11,15,19,29H,8-10,25H2/t15-,19+/m1/s1
InChiKey IKHJNNVQIHFMCA-BEFAXECRSA-N
Formula C21H19F3N4O Molecular Weight 400.40
Cross Link CHEMBL391252
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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