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Drug Details

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Name:CHEMBL1089615
PubChem ID:46884387
Pathway:Show KEGG pathways
InChI:InChI=1S/C31H43F4N5O2S/c1-2-29(42)39-15-10-27-25(21-39)30(36-40(27)20-24(41)19-38-11-4-3-5-12-38)22-6-7-26(31(33,34)35)28(18-22)43-17-16-37-13-8-23(32)9-14-37/h6-7,18,23-24,41H,2-5,8-17,19-21H2,1H3/t24-/m0/s1
SMILES:CCC(=O)N1CCc2c(C1)c(nn2C[C@H](CN1CCCCC1)O)c1ccc(c(c1)SCCN1CCC(CC1)F)C(F)(F)F

Properties:
Formula:C31H43F4N5O2SAtoms:43
Molecular Weight:625.764Rotatable Bonds:12
H-bond Acceptors:8H-bond Donors:1
logP:5.0501
Targets:
NameUniprot IDSourceReferencesInteraction
Cathepsin SCATS_HUMANBindingDB-shows
Synonyms:
CHEBI:720490
CHEMBL1089615