CFam Chemical Families Database
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You are searching for "CFAMM00410420" 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 CFAMM00410420
Family CFFBM11557 Substance-P receptor ligand SureCN7659714 family
Superfamily CFSBM891 Mitogen-activated protein kinase 13 and Mitogen-activated protein kinase 14 Binder Superfamily
Class CFCAD181 Class 181
External ID CHEMBL279442 External Source CHEMBL
PubChem CID 10186401 Functional Category Bioactive
Molecule Name SureCN7572338
IUPAC Name 1-(4-benzyl-4-hydroxypiperidin-1-yl)-3-[5-chloro-2-(4-chlorophenyl)-1-methylpyrrolo[2,3-b]pyridin-3-yl]propan-1-one
Synonyms CHEBI:126169
InChi InChI=1S/C29H29Cl2N3O2/c1-33-27(21-7-9-22(30)10-8-21)24(25-17-23(31)19-32-28(25)33)11-12-26(35)34-15-13-29(36,14-16-34)18-20-5-3-2-4-6-20/h2-10,17,19,36H,11-16,18H2,1H3
InChiKey RIYFBUBBDKMFDL-UHFFFAOYSA-N
Formula C29H29Cl2N3O2 Molecular Weight 522.47
Cross Link CHEMBL279442
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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