CFam Chemical Families Database
BIDD Pharmainformatics Databases
You are searching for "CFAMM00175888" in compound.

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CFAM Mol ID CFAMM00175888
Family CFFID42 Reverse transcriptase Inhibitor 3-benzylamino-5-ethyl-6-methyl-1h-pyridin-2-one Family
Superfamily CFSID30 Reverse transcriptase Inhibitor 3-benzylamino-5-ethyl-6-methyl-1h-pyridin-2-one Superfamily
Class CFCCD411 Class 1224
External ID ZINC12660135 External Source ZINC
PubChem CID 25425631 Functional Category Natural Product
Molecule Name (S,E)-3-((S)-sec-butyl)-6-(2-fluorobenzylidene)piperazine-2,5-dione
IUPAC Name (3S,6E)-3-[(2R)-butan-2-yl]-6-[(2-fluorophenyl)methylidene]piperazine-2,5-dione
InChi InChI=1S/C15H17FN2O2/c1-3-9(2)13-15(20)17-12(14(19)18-13)8-10-6-4-5-7-11(10)16/h4-9,13H,3H2,1-2H3,(H,17,20)(H,18,19)/b12-8+/t9-,13+/m1/s1
Formula C15H17FN2O2 Molecular Weight 276.31
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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).

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