CFam Chemical Families Database
BIDD Pharmainformatics Databases
 
   
You are searching for "CFAMM00440074" 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 CFAMM00440074
Family CFFBM16979 G2/mitotic-specific cyclin-B2 and Cyclin-dependent kinase 1 inhibitor SureCN13007958 family
Superfamily CFSBM1349 Substance-P receptor and Dipeptidyl peptidase 4 Binder Superfamily 2
Class CFCCD218 Class 1031
External ID CHEMBL389102 External Source CHEMBL
PubChem CID 44430913 Functional Category Bioactive
Molecule Name 2-[4-(2-hydroxyethyl)anilino]-4-(1H-indol-5-yl)pyrimidine-5-carbonitrile
IUPAC Name 2-[4-(2-hydroxyethyl)anilino]-4-(1H-indol-5-yl)pyrimidine-5-carbonitrile
Synonyms AGN-PC-07699G;CHEBI:494865;2-[4-(2-hydroxyethyl)anilino]-4-(1H-indol-5-yl)pyrimidine-5-carbonitrile
InChi InChI=1S/C21H17N5O/c22-12-17-13-24-21(25-18-4-1-14(2-5-18)8-10-27)26-20(17)16-3-6-19-15(11-16)7-9-23-19/h1-7,9,11,13,23,27H,8,10H2,(H,24,25,26)
InChiKey XNHXNJLWTFRLFQ-UHFFFAOYSA-N
Formula C21H17N5O Molecular Weight 355.39
Cross Link CHEMBL389102
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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