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Name:CHEMBL593928
PubChem ID:46228117
Pathway:Show KEGG pathways
InChI:InChI=1S/C36H34O12S/c1-41-25-8-6-24(7-9-25)36(38)28(33(35(37)48-36)23-5-14-29-30(20-23)47-21-46-29)17-22-18-31(42-2)34(43-3)32(19-22)45-16-15-44-26-10-12-27(13-11-26)49(4,39)40/h5-14,18-20,38H,15-17,21H2,1-4H3
SMILES:COc1ccc(cc1)C1(O)OC(=O)C(=C1Cc1cc(OCCOc2ccc(cc2)S(=O)(=O)C)c(c(c1)OC)OC)c1ccc2c(c1)OCO2

Properties:
Formula:C36H34O12SAtoms:49
Molecular Weight:690.713Rotatable Bonds:13
H-bond Acceptors:12H-bond Donors:1
logP:5.7816
Targets:
NameUniprot IDSourceReferencesInteraction
Endothelin-1 receptorEDNRA_MOUSEBindingDB-shows
Synonyms:
CHEBI:695693
CHEMBL593928