Home
Drugs
Targets
Pathways
Ontologies
Cyp450s
Adv.search
Help/FAQ

Drug Details

add
Name:CHEMBL369525
PubChem ID:44390653
Pathway:Show KEGG pathways
InChI:InChI=1S/C34H31ClFNO3/c1-21-28-17-23(24-11-15-26(29(36)18-24)27-7-5-6-8-32(27)40-4)12-16-30(28)37(20-22-9-13-25(35)14-10-22)31(21)19-34(2,3)33(38)39/h5-18H,19-20H2,1-4H3,(H,38,39)
SMILES:COc1ccccc1c1ccc(cc1F)c1ccc2c(c1)c(C)c(n2Cc1ccc(cc1)Cl)CC(C(=O)O)(C)C

Properties:
Formula:C34H31ClFNO3Atoms:40
Molecular Weight:556.066Rotatable Bonds:8
H-bond Acceptors:4H-bond Donors:1
logP:8.7864
Targets:
NameUniprot IDSourceReferencesInteraction
Prostaglandin E synthase 2PGES2_HUMANBindingDB-shows
Synonyms:
CHEBI:402798
CHEMBL369525