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Ligand

NameMLS001106195
Molecular formulaC15H23NO5S
IUPAC nameethyl (2R,3R)-2-benzyl-3-sulfamoyloxyhexanoate
Molecular weight329.411
Hydrogen bond acceptor6
Hydrogen bond donor1
XlogP2.5
SynonymsCHEMBL1723409
HMS2193P03
SMR000639503
Inchi KeyABZWYPZEINVXSD-ZIAGYGMSSA-N
Inchi IDInChI=1S/C15H23NO5S/c1-3-8-14(21-22(16,18)19)13(15(17)20-4-2)11-12-9-6-5-7-10-12/h5-7,9-10,13-14H,3-4,8,11H2,1-2H3,(H2,16,18,19)/t13-,14-/m1/s1
PubChem CID24761761
ChEMBLCHEMBL1723409
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
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GLASS IDNameUniProtGeneSpeciesLength
463123Parathyroid hormone/parathyroid hormone-related peptide receptorQ03431PTH1RHomo sapiens (Human)593

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