CFam Chemical Families Database
BIDD Pharmainformatics Databases
You are searching for "CFAMM00519870" in compound.

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CFAM Mol ID CFAMM00519870
Family CFFBM42666 P2Y purinoceptor 12 inhibitor SureCN3923520 family
Superfamily CFSBM3670 P2Y purinoceptor 12 and Histone deacetylase 1 Binder Superfamily
Class CFCBM959 Class 4009
External ID CHEMBL2402271 External Source CHEMBL
PubChem CID 24751017 Functional Category Bioactive
Molecule Name ethyl 6-[4-(benzoylcarbamothioyl)piperazin-1-yl]-5-chloropyridine-3-carboxylate
IUPAC Name ethyl 6-[4-(benzoylcarbamothioyl)piperazin-1-yl]-5-chloropyridine-3-carboxylate
InChi InChI=1S/C20H21ClN4O3S/c1-2-28-19(27)15-12-16(21)17(22-13-15)24-8-10-25(11-9-24)20(29)23-18(26)14-6-4-3-5-7-14/h3-7,12-13H,2,8-11H2,1H3,(H,23,26,29)
Formula C20H21ClN4O3S Molecular Weight 432.92
Cross Link CHEMBL2402271

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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National University of Singapore, Singapore

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