CFam Chemical Families Database
BIDD Pharmainformatics Databases
 
   
You are searching for "CFAMM00257085" 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 CFAMM00257085
Family CFFID2012 Poly [ADP-ribose] polymerase 1 Inhibitor 2-ethylquinoline-8-carboxamide Family
Superfamily CFSID1509 Poly [ADP-ribose] polymerase 1 Binder Superfamily 4
Class CFCCD265 Class 1078
External ID 5492126 External Source PubChem
PubChem CID 5492126 Functional Category Patent Compound
Molecule Name 55149-04-7
IUPAC Name ethyl 4-oxo-1H-pyrimido[4,5-b]quinoline-2-carboxylate
Synonyms Ethyl 3,4-dihydro-4-oxopyrimido(4,5-b)quinoline-2-carboxylate;ETHYL 3,4-DIHYDRO-4-OXOPYRIMIDO[4,5-B]QUINOLINE-2-CARBOXYLATE;AC1NUSWK;SureCN11547661;CHEMBL315672;CTK5A3113;AG-F-92535;ethyl 4-oxo-1H-pyrimido[4,5-b]quinoline-2-carboxylate;Pyrimido(4,5-b)quinoline-2-carboxylic acid, 1,4-dihydro-4-oxo-, ethyl ester
InChi InChI=1S/C14H11N3O3/c1-2-20-14(19)12-16-11-9(13(18)17-12)7-8-5-3-4-6-10(8)15-11/h3-7H,2H2,1H3,(H,15,16,17,18)
InChiKey JBRDALJZMUEMPV-UHFFFAOYSA-N
Formula C14H11N3O3 Molecular Weight 269.26
Cross Link CHEMBL315672
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
 

 

27698 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', 'CFAMM00257085'),None, txtsearch, CFAMM00257085|