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Name:CHEMBL413240
PubChem ID:44429009
Pathway:Show KEGG pathways
InChI:InChI=1S/C50H76N6O2/c1-37-31-39-33-45-43(19-21-47(57)51-45)49(35-37)41(39)17-13-27-55(49)29-15-25-53(3)23-11-9-7-5-6-8-10-12-24-54(4)26-16-30-56-28-14-18-42-40-32-38(2)36-50(42,56)44-20-22-48(58)52-46(44)34-40/h19-22,31-32,39-42H,5-18,23-30,33-36H2,1-4H3,(H,51,57)(H,52,58)/t39?,40?,41?,42?,49-,50-/m1/s1
SMILES:CN(CCCN1CCC[C@H]2[C@]31CC(=C[C@H]2Cc1c3ccc(=O)[nH]1)C)CCCCCCCCCCN(CCCN1CCC[C@H]2[C@]31CC(=C[C@H]2Cc1c3ccc(=O)[nH]1)C)C

Properties:
Formula:C50H76N6O2Atoms:58
Molecular Weight:793.177Rotatable Bonds:19
H-bond Acceptors:6H-bond Donors:2
logP:8.263
Targets:
NameUniprot IDSourceReferencesInteraction
AcetylcholinesteraseACES_RATBindingDB-shows
Synonyms:
CHEBI:491821
CHEMBL413240