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Ligand

NameMLS000037230
Molecular formulaC16H16N2O5S2
IUPAC nameN-[2-(furan-2-ylmethylsulfanyl)ethyl]-2-(1,1,3-trioxo-1,2-benzothiazol-2-yl)acetamide
Molecular weight380.433
Hydrogen bond acceptor6
Hydrogen bond donor1
XlogP1.2
SynonymsCHEMBL1347805
N-[2-(2-furfurylthio)ethyl]-2-(1,1,3-triketo-1,2-benzothiazol-2-yl)acetamide
STK946782
2-(1,1-dioxido-3-oxo-1,2-benzothiazol-2(3H)-yl)-N-{2-[(furan-2-ylmethyl)sulfanyl]ethyl}acetamide
AH-487/42142711
[ Show all ]
Inchi KeyAEGKXBLYXZRJOF-UHFFFAOYSA-N
Inchi IDInChI=1S/C16H16N2O5S2/c19-15(17-7-9-24-11-12-4-3-8-23-12)10-18-16(20)13-5-1-2-6-14(13)25(18,21)22/h1-6,8H,7,9-11H2,(H,17,19)
PubChem CID662420
ChEMBLCHEMBL1347805
IUPHARN/A
BindingDBN/A
DrugBankN/A

Structure

SDF download

2D structure
Lipinski's druglikenessThis ligand satisfies Lipinski's rule of five.

Known GPCRs

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Total entries: 1
Page:  / 1 

GLASS IDNameUniProtGeneSpeciesLength
463302Parathyroid hormone/parathyroid hormone-related peptide receptorQ03431PTH1RHomo sapiens (Human)593

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