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

Drug Details

add
Name:CHEMBL395274
PubChem ID:15974923
Pathway:Show KEGG pathways
InChI:InChI=1S/C40H52N6O4/c1-25-17-27-19-33-31(9-11-35(47)41-33)39(21-25)29(27)7-5-13-45(39)37(49)23-43(3)15-16-44(4)24-38(50)46-14-6-8-30-28-18-26(2)22-40(30,46)32-10-12-36(48)42-34(32)20-28/h9-12,17-18,27-30H,5-8,13-16,19-24H2,1-4H3,(H,41,47)(H,42,48)/t27?,28?,29?,30?,39-,40-/m1/s1
SMILES:CN(CC(=O)N1CCC[C@H]2[C@]31CC(=C[C@H]2Cc1c3ccc(=O)[nH]1)C)CCN(CC(=O)N1CCC[C@H]2[C@]31CC(=C[C@H]2Cc1c3ccc(=O)[nH]1)C)C

Properties:
Formula:C40H52N6O4Atoms:50
Molecular Weight:680.879Rotatable Bonds:9
H-bond Acceptors:8H-bond Donors:2
logP:3.4152
Targets:
NameUniprot IDSourceReferencesInteraction
AcetylcholinesteraseACES_RATBindingDB-shows
Synonyms:
CHEBI:491772
CHEMBL395274