CFam Chemical Families Database
BIDD Pharmainformatics Databases
 
   
You are searching for "CFAMM00190826" 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 CFAMM00190826
Family CFFID416 5-hydroxytryptamine receptor 2B Ligand MT-500 Family
Superfamily CFSCD104 Transient receptor potential cation channel subfamily V member 1 Ligand NGD-8243 Superfamily
Class CFCCD90 Class 903
External ID CHEMBL255543 External Source CHEMBL
PubChem CID 16062785 Functional Category Bioactive
Molecule Name 4-(4-fluorophenyl)-2-propan-2-yl-6,7,8,9-tetrahydro-5H-pyrimido[4,5-d]azepine
IUPAC Name 4-(4-fluorophenyl)-2-propan-2-yl-6,7,8,9-tetrahydro-5H-pyrimido[4,5-d]azepine
Synonyms SureCN300620;AGN-PC-00SB00;4-(4-fluorophenyl)-2-propan-2-yl-6,7,8,9-tetrahydro-5H-pyrimido[4,5-d]azepine
InChi InChI=1S/C17H20FN3/c1-11(2)17-20-15-8-10-19-9-7-14(15)16(21-17)12-3-5-13(18)6-4-12/h3-6,11,19H,7-10H2,1-2H3
InChiKey SKILTOYZHWNFFT-UHFFFAOYSA-N
Formula C17H20FN3 Molecular Weight 285.36
Cross Link CHEMBL255543
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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