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Drug Details

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Name:CHEMBL553409
PubChem ID:45270404
Pathway:Show KEGG pathways
InChI:InChI=1S/C27H30N6O4S2.C2HF3O2/c28-13-20-8-11-23-24(12-20)38-16-22(32-39(36,37)17-19-4-2-1-3-5-19)27(35)33(23)15-25(34)31-14-18-6-9-21(10-7-18)26(29)30;3-2(4,5)1(6)7/h1-12,22,32H,13-17,28H2,(H3,29,30)(H,31,34);(H,6,7)/t22-;/m1./s1
SMILES:OC(=O)C(F)(F)F.NCc1ccc2c(c1)SC[C@H](C(=O)N2CC(=O)NCc1ccc(cc1)C(=N)N)NS(=O)(=O)Cc1ccccc1

Properties:
Formula:C29H31F3N6O6S2Atoms:46
Molecular Weight:680.718Rotatable Bonds:12
H-bond Acceptors:13H-bond Donors:6
logP:5.7339
Targets:
Synonyms:
CHEBI:661299
CHEMBL553409