CFam Chemical Families Database
BIDD Pharmainformatics Databases
You are searching for "CFAMM00279280" in compound.

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CFAM Mol ID CFAMM00279280
Family CFFID2891 B2 bradykinin receptor Ligand FR-173657 Family
Superfamily CFSID2045 B2 bradykinin receptor Ligand FR-173657 Superfamily
Class CFCID664 Class 2014
External ID CHEMBL98458 External Source CHEMBL
PubChem CID 11169975 Functional Category Bioactive
Molecule Name SureCN6964858
IUPAC Name (E)-3-(6-acetamidopyridin-3-yl)-N-[2-[2,4-dichloro-N-methyl-3-[[2-methyl-4-(pyridin-2-ylmethoxy)quinolin-8-yl]oxymethyl]anilino]-2-oxoethyl]prop-2-enamide
Synonyms CHEBI:258824
InChi InChI=1S/C36H32Cl2N6O5/c1-22-17-31(48-20-25-7-4-5-16-39-25)26-8-6-9-30(36(26)42-22)49-21-27-28(37)12-13-29(35(27)38)44(3)34(47)19-41-33(46)15-11-24-10-14-32(40-18-24)43-23(2)45/h4-18H,19-21H2,1-3H3,(H,41,46)(H,40,43,45)/b15-11+
Formula C36H32Cl2N6O5 Molecular Weight 699.58
Cross Link CHEMBL98458

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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