CFam Chemical Families Database
BIDD Pharmainformatics Databases
You are searching for "CFAMM00440962" in compound.

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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 CFAMM00440962
Family CFFBM17178 Cholecystokinin receptor type A ligand AGN-PC-077L8J family
Superfamily CFSBM158 Cholecystokinin receptor type A and Prelamin-A/C Binder Superfamily
Class CFCAD227 Class 227
External ID CHEMBL446502 External Source CHEMBL
PubChem CID 44562309 Functional Category Bioactive
Molecule Name 1-[[(2S)-1-[1-(3-ethoxyphenyl)-2-(4-methylphenyl)imidazole-4-carbonyl]-4-quinolin-3-ylpiperazin-2-yl]methyl]-3-methylurea
IUPAC Name 1-[[(2S)-1-[1-(3-ethoxyphenyl)-2-(4-methylphenyl)imidazole-4-carbonyl]-4-quinolin-3-ylpiperazin-2-yl]methyl]-3-methylurea
Synonyms CHEBI:551282
InChi InChI=1S/C35H37N7O3/c1-4-45-30-10-7-9-27(19-30)42-23-32(39-33(42)25-14-12-24(2)13-15-25)34(43)41-17-16-40(22-29(41)21-38-35(44)36-3)28-18-26-8-5-6-11-31(26)37-20-28/h5-15,18-20,23,29H,4,16-17,21-22H2,1-3H3,(H2,36,38,44)/t29-/m0/s1
Formula C35H37N7O3 Molecular Weight 603.71
Cross Link CHEMBL446502

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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