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Drug Details

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Name:CHEMBL611626
PubChem ID:46228118
Pathway:Show KEGG pathways
InChI:InChI=1S/C36H34O12S/c1-41-31-18-22(19-32(42-2)34(31)43-3)17-28-33(23-5-14-29-30(20-23)47-21-46-29)35(37)48-36(28,38)24-6-8-25(9-7-24)44-15-16-45-26-10-12-27(13-11-26)49(4,39)40/h5-14,18-20,38H,15-17,21H2,1-4H3
SMILES:COc1c(OC)cc(cc1OC)CC1=C(c2ccc3c(c2)OCO3)C(=O)OC1(O)c1ccc(cc1)OCCOc1ccc(cc1)S(=O)(=O)C

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:695694
CHEMBL611626