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Drug Details

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Name:CHEMBL554542
PubChem ID:45266923
Pathway:Show KEGG pathways
InChI:InChI=1S/C32H31N5O4S2.C2HF3O2/c33-31(34)25-13-11-22(12-14-25)18-35-30(38)19-37-28-17-26(24-9-5-2-6-10-24)15-16-29(28)42-20-27(32(37)39)36-43(40,41)21-23-7-3-1-4-8-23;3-2(4,5)1(6)7/h1-17,27,36H,18-21H2,(H3,33,34)(H,35,38);(H,6,7)/t27-;/m1./s1
SMILES:OC(=O)C(F)(F)F.O=C(CN1C(=O)[C@@H](CSc2c1cc(cc2)c1ccccc1)NS(=O)(=O)Cc1ccccc1)NCc1ccc(cc1)C(=N)N

Properties:
Formula:C34H32F3N5O6S2Atoms:50
Molecular Weight:727.773Rotatable Bonds:12
H-bond Acceptors:12H-bond Donors:5
logP:7.2419
Targets:
NameUniprot IDSourceReferencesInteraction
Tissue factorTF_HUMANBindingDB-shows
Synonyms:
CHEBI:654250
CHEMBL554542