CFam Chemical Families Database
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You are searching for "CFAMM00485237" in compound.

Total 1 results found.

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 CFAMM00485237
Family CFFBM28252 Calcitonin gene-related peptide type 1 receptor ligand SureCN3254337 family
Superfamily CFSBM3250 Prelamin-A/C and Nuclear receptor ROR-gamma Binder Superfamily 13
Class CFCID1116 Class 2466
External ID CHEMBL384799 External Source CHEMBL
PubChem CID 11699986 Functional Category Bioactive
Molecule Name SureCN3254337
IUPAC Name 4-(3-oxo-5-phenyl-1H-1,2,4-triazol-2-yl)-N-[(3R)-2-oxo-5-phenyl-1-(2,2,2-trifluoroethyl)-3H-1,4-benzodiazepin-3-yl]piperidine-1-carboxamide
Synonyms CHEBI:459861
InChi InChI=1S/C31H28F3N7O3/c32-31(33,34)19-40-24-14-8-7-13-23(24)25(20-9-3-1-4-10-20)35-27(28(40)42)37-29(43)39-17-15-22(16-18-39)41-30(44)36-26(38-41)21-11-5-2-6-12-21/h1-14,22,27H,15-19H2,(H,37,43)(H,36,38,44)/t27-/m0/s1
InChiKey SAPYIDWHUPVUPO-MHZLTWQESA-N
Formula C31H28F3N7O3 Molecular Weight 603.59
Cross Link CHEMBL384799
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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