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Ligand

NameAC1NJXT4
Molecular formulaC25H24N2O5S
IUPAC name4-methoxy-N-(4-methoxyphenyl)-N-[(8-methyl-2-oxo-1H-quinolin-3-yl)methyl]benzenesulfonamide
Molecular weight464.536
Hydrogen bond acceptor6
Hydrogen bond donor1
XlogP3.9
SynonymsHMS2930K10
ZINC9452403
4-methoxy-N-(4-methoxyphenyl)-N-[(8-methyl-2-oxo-1,2-dihydroquinolin-3-yl)methyl]benzenesulfonamide
MolPort-000-811-075
SMR000650281
[ Show all ]
Inchi KeyABDUJZSUPAOZCM-UHFFFAOYSA-N
Inchi IDInChI=1S/C25H24N2O5S/c1-17-5-4-6-18-15-19(25(28)26-24(17)18)16-27(20-7-9-21(31-2)10-8-20)33(29,30)23-13-11-22(32-3)12-14-23/h4-15H,16H2,1-3H3,(H,26,28)
PubChem CID4904517
ChEMBLCHEMBL1559304
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
463040Parathyroid hormone/parathyroid hormone-related peptide receptorQ03431PTH1RHomo sapiens (Human)593

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