CFam Chemical Families Database
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You are searching for "CFAMM00383876" in compound.

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CFAM Mol ID CFAMM00383876
Family CFFBM7884 Calcitonin gene-related peptide type 1 receptor ligand SureCN12219678 family
Superfamily CFSBM4317 Calcitonin gene-related peptide type 1 receptor and Integrin beta-3 Binder Superfamily
Class CFCBM224 Class 3274
External ID CHEMBL1770714 External Source CHEMBL
PubChem CID 54580838 Functional Category Bioactive
Molecule Name SureCN12219678
IUPAC Name N-[(6S,9R)-6-(2,3-difluorophenyl)-3-(methoxymethyl)-6,7,8,9-tetrahydro-5H-imidazo[1,2-a]azepin-9-yl]-4-(2-oxo-3H-imidazo[4,5-b]pyridin-1-yl)piperidine-1-carboxamide
Synonyms CHEBI:1243018
InChi InChI=1S/C28H31F2N7O3/c1-40-16-19-14-32-26-22(8-7-17(15-36(19)26)20-4-2-5-21(29)24(20)30)33-27(38)35-12-9-18(10-13-35)37-23-6-3-11-31-25(23)34-28(37)39/h2-6,11,14,17-18,22H,7-10,12-13,15-16H2,1H3,(H,33,38)(H,31,34,39)/t17-,22-/m1/s1
InChiKey DJPVYVKVYULAAE-VGOFRKELSA-N
Formula C28H31F2N7O3 Molecular Weight 551.59
Cross Link CHEMBL1770714
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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