CFam Chemical Families Database
BIDD Pharmainformatics Databases
 
   
You are searching for "CFAMM00331543" 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.

Search Results

CFAM Mol ID CFAMM00331543
Family CFFBM2224 Mitogen-activated protein kinase 14 inhibitor N-cyclopropyl-4-methyl-3-[[5-methyl-6-(1H-pyrrole-2-carbonyl)pyrrolo[2,1-f][1,2,4]triazin-4-yl]amino]benzamide family
Superfamily CFSID46 XL-888 Superfamily
Class CFCCD240 Class 1053
External ID CHEMBL252126 External Source CHEMBL
PubChem CID 24755185 Functional Category Bioactive
Molecule Name methyl 5-methyl-4-[2-methyl-5-(methylcarbamoyl)anilino]pyrrolo[2,1-f][1,2,4]triazine-6-carboxylate
IUPAC Name methyl 5-methyl-4-[2-methyl-5-(methylcarbamoyl)anilino]pyrrolo[2,1-f][1,2,4]triazine-6-carboxylate
Synonyms pyrrolo[2,1-f][1,2,4]triazine analogue, 3a
InChi InChI=1S/C18H19N5O3/c1-10-5-6-12(17(24)19-3)7-14(10)22-16-15-11(2)13(18(25)26-4)8-23(15)21-9-20-16/h5-9H,1-4H3,(H,19,24)(H,20,21,22)
InChiKey LBJLZUGWQIZPOF-UHFFFAOYSA-N
Formula C18H19N5O3 Molecular Weight 353.38
Cross Link CHEMBL252126
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
 

 

57975 visits since 2014 .........

 



Dr. Chen Yuzong

Deputy Director of Center for Computational Science and Engineering
Professor in Department of Pharmacy
National University of Singapore, Singapore


All rights reserved.

   
 
 
Computer-aided Drug Design
about BIDD |  databases |  software |  teaching |  research |  links

 

Department of Computational Science | National University of Singapore | Blk S17, 3 Science Drive 2, Singapore 117543

hdnkeywordtype:MiniFieldStorage('hdnkeywordtype', 'compound'),None, hdnkeywordtype, compound|txtsearch:MiniFieldStorage('txtsearch', 'CFAMM00331543'),None, txtsearch, CFAMM00331543|