CFam Chemical Families Database
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You are searching for "CFAMM00413381" in compound.

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CFAM Mol ID CFAMM00413381
Family CFFBM12020 Prostaglandin D2 receptor 2 ligand 2-[5-fluoro-3-[[1-[[4-(2-hydroxypropan-2-yl)phenyl]methyl]-6-oxopyridazin-3-yl]methyl]-2-methylindol-1-yl]acetic acid family
Superfamily CFSBM5643 Prostaglandin D2 receptor 2 and Cytochrome P450 2C19 Binder Superfamily
Class CFCCD113 Class 926
External ID CHEMBL2204472 External Source CHEMBL
PubChem CID 57505238 Functional Category Bioactive
Molecule Name 2-[5-fluoro-3-[[1-[[4-(2-hydroxypropan-2-yl)phenyl]methyl]-6-oxopyridazin-3-yl]methyl]-2-methylindol-1-yl]acetic acid
IUPAC Name 2-[5-fluoro-3-[[1-[[4-(2-hydroxypropan-2-yl)phenyl]methyl]-6-oxopyridazin-3-yl]methyl]-2-methylindol-1-yl]acetic acid
Synonyms AGN-PC-0BV8TK;SureCN1757713;2-[5-fluoro-3-[[1-[[4-(2-hydroxypropan-2-yl)phenyl]methyl]-6-oxopyridazin-3-yl]methyl]-2-methylindol-1-yl]acetic acid
InChi InChI=1S/C26H26FN3O4/c1-16-21(22-12-19(27)8-10-23(22)29(16)15-25(32)33)13-20-9-11-24(31)30(28-20)14-17-4-6-18(7-5-17)26(2,3)34/h4-12,34H,13-15H2,1-3H3,(H,32,33)
InChiKey FCVZIFQYQJBRKV-UHFFFAOYSA-N
Formula C26H26FN3O4 Molecular Weight 463.50
Cross Link CHEMBL2204472
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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