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

Drug Details

add
Name:CHEMBL100718
PubChem ID:44331913
Pathway:Show KEGG pathways
InChI:InChI=1S/C28H29N3O4S/c1-31(18-19-7-3-2-4-8-19)14-16-35-15-13-29-28(36)30-27(34)20-11-12-23-24(17-20)26(33)22-10-6-5-9-21(22)25(23)32/h2-12,17,23-24H,13-16,18H2,1H3,(H2,29,30,34,36)
SMILES:CN(Cc1ccccc1)CCOCCNC(=S)NC(=O)C1=CC2C(C=C1)C(=O)c1c(C2=O)cccc1

Properties:
Formula:C28H29N3O4SAtoms:36
Molecular Weight:503.613Rotatable Bonds:12
H-bond Acceptors:8H-bond Donors:2
logP:3.7153
Targets:
NameUniprot IDSourceReferencesInteraction
AcetylcholinesteraseACES_RATBindingDB-shows
Synonyms:
CHEBI:265029
CHEMBL100718