CFam Chemical Families Database
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You are searching for "CFAMM00398910" 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 CFAMM00398910
Family CFFBM9973 Vascular endothelial growth factor receptor 2 ligand AGN-PC-00D36M family
Superfamily CFSAD219 Alpha-1D adrenergic receptor Ligand Terazosin Superfamily
Class CFCAD211 Class 211
External ID CHEMBL370356 External Source CHEMBL
PubChem CID 11578019 Functional Category Bioactive
Molecule Name AGN-PC-00BYKH
IUPAC Name 2-[[6-methoxy-7-(3-pyrrolidin-1-ylpropoxy)quinazolin-4-yl]amino]-5-[(2,3,4,5,6-pentafluorophenyl)methoxy]cyclohexa-2,5-diene-1,4-dione
Synonyms CHEBI:432631;2-[[6-methoxy-7-(3-pyrrolidin-1-ylpropoxy)quinazolin-4-yl]amino]-5-[(2,3,4,5,6-pentafluorophenyl)methoxy]cyclohexa-2,5-diene-1,4-dione
InChi InChI=1S/C29H25F5N4O5/c1-41-22-9-15-17(11-23(22)42-8-4-7-38-5-2-3-6-38)35-14-36-29(15)37-18-10-20(40)21(12-19(18)39)43-13-16-24(30)26(32)28(34)27(33)25(16)31/h9-12,14,40H,2-8,13H2,1H3/b37-18-
InChiKey RUTBNNGABABVLZ-AEVGBRMKSA-N
Formula C29H25F5N4O5 Molecular Weight 604.52
Cross Link CHEMBL370356
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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