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Drug Details

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Name:CHEMBL1089609
PubChem ID:46884381
Pathway:Show KEGG pathways
InChI:InChI=1S/C31H45F4N5O3S2/c1-2-18-45(42,43)39-15-10-28-26(22-39)30(36-40(28)21-25(41)20-38-11-4-3-5-12-38)23-6-7-27(31(33,34)35)29(19-23)44-17-16-37-13-8-24(32)9-14-37/h6-7,19,24-25,41H,2-5,8-18,20-22H2,1H3/t25-/m0/s1
SMILES:CCCS(=O)(=O)N1CCc2c(C1)c(nn2C[C@H](CN1CCCCC1)O)c1ccc(c(c1)SCCN1CCC(CC1)F)C(F)(F)F

Properties:
Formula:C31H45F4N5O3S2Atoms:45
Molecular Weight:675.844Rotatable Bonds:13
H-bond Acceptors:9H-bond Donors:1
logP:5.9341
Targets:
NameUniprot IDSourceReferencesInteraction
Cathepsin SCATS_HUMANBindingDB-shows
Synonyms:
CHEBI:720484
CHEMBL1089609