Home
Drugs
Targets
Pathways
Ontologies
Cyp450s
Adv.search
Help/FAQ

Drug Details

add
Name:CHEMBL193985
PubChem ID:44402977
Pathway:Show KEGG pathways
InChI:InChI=1S/C32H32F2N4O4.C2HF3O2/c1-18(2)21-14-15-25(24(17-21)32(39)40)42-31-27(34)28(37-19(3)12-13-20-8-5-4-6-9-20)26(33)30(38-31)41-23-11-7-10-22(16-23)29(35)36;3-2(4,5)1(6)7/h4-11,14-19H,12-13H2,1-3H3,(H3,35,36)(H,37,38)(H,39,40);(H,6,7)
SMILES:OC(=O)C(F)(F)F.CC(Nc1c(F)c(nc(c1F)Oc1cccc(c1)C(=N)N)Oc1ccc(cc1C(=O)O)C(C)C)CCc1ccccc1

Properties:
Formula:C34H33F5N4O6Atoms:49
Molecular Weight:688.641Rotatable Bonds:13
H-bond Acceptors:10H-bond Donors:5
logP:8.9896
Targets:
Synonyms:
CHEBI:426871
CHEMBL193985