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

Drug Details

add
Name:CHEMBL1254967
PubChem ID:11642413
Pathway:Show KEGG pathways
InChI:InChI=1S/C28H33ClN2O5S/c1-37-28-25(31-24(32)12-13-30)27(35-16-19-6-9-20-4-2-3-5-21(20)14-19)26(33)23(36-28)17-34-15-18-7-10-22(29)11-8-18/h2-11,14,23,25-28,33H,12-13,15-17,30H2,1H3,(H,31,32)/t23-,25-,26-,27+,28+/m1/s1
SMILES:NCCC(=O)N[C@H]1[C@H](SC)O[C@@H]([C@H]([C@H]1OCc1ccc2c(c1)cccc2)O)COCc1ccc(cc1)Cl

Properties:
Formula:C28H33ClN2O5SAtoms:37
Molecular Weight:545.09Rotatable Bonds:12
H-bond Acceptors:8H-bond Donors:3
logP:4.9688
Targets:
Synonyms:
CHEBI:804436
CHEMBL1254967
CID 11642413
CID11642413