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

Drug Details

add
Name:CHEMBL178207
PubChem ID:44389574
Pathway:Show KEGG pathways
InChI:InChI=1S/C28H36ClNO2S/c1-18(2)20-11-14-23-22(15-20)25(33-27(3,4)5)24(16-28(6,7)26(31)32-8)30(23)17-19-9-12-21(29)13-10-19/h9-15,18H,16-17H2,1-8H3
SMILES:COC(=O)C(Cc1c(SC(C)(C)C)c2c(n1Cc1ccc(cc1)Cl)ccc(c2)C(C)C)(C)C

Properties:
Formula:C28H36ClNO2SAtoms:33
Molecular Weight:486.109Rotatable Bonds:9
H-bond Acceptors:4H-bond Donors:0
logP:8.0987
Targets:
NameUniprot IDSourceReferencesInteraction
Prostaglandin E synthase 2PGES2_HUMANBindingDB-shows
Synonyms:
CHEBI:401025
CHEMBL178207
TCMDC-131973