CFam Chemical Families Database
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You are searching for "CFAMM00385750" 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 CFAMM00385750
Family CFFBM8125 Vascular endothelial growth factor receptor 2 ligand SureCN4051578 family
Superfamily CFSBM1294 Adenosine receptor A1 and Adenosine receptor A3 Binder Superfamily 3
Class CFCBM498 Class 3548
External ID 23589550 External Source PubChem
PubChem CID 23589550 Functional Category Patent Compound
Molecule Name AGN-PC-045PBF
IUPAC Name ethyl 5-ethyl-4-(3-hydroxy-4-methylanilino)pyrrolo[2,1-f][1,2,4]triazine-6-carboxylate
Synonyms SureCN4042412;ethyl 5-ethyl-4-(3-hydroxy-4-methylanilino)pyrrolo[2,1-f][1,2,4]triazine-6-carboxylate
InChi InChI=1S/C18H20N4O3/c1-4-13-14(18(24)25-5-2)9-22-16(13)17(19-10-20-22)21-12-7-6-11(3)15(23)8-12/h6-10,23H,4-5H2,1-3H3,(H,19,20,21)
InChiKey VPJQAWXLRDNIOY-UHFFFAOYSA-N
Formula C18H20N4O3 Molecular Weight 340.38
Cross Link
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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