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Ligand

NameCHEMBL1355684
Molecular formulaC24H17N3O5S
IUPAC name2-(7-hydroxy-2-oxochromen-3-yl)-5-methyl-N-(3-methylphenyl)-4-oxo-3H-thieno[2,3-d]pyrimidine-6-carboxamide
Molecular weight459.476
Hydrogen bond acceptor7
Hydrogen bond donor3
XlogP4.1
SynonymsHMS1860L02
NCGC00120968-01
2-(7-hydroxy-2-oxo-2H-chromen-3-yl)-5-methyl-N-(3-methylphenyl)-4-oxo-3,4-dihydrothieno[2,3-d]pyrimidine-6-carboxamide
MCULE-5481897204
ZINC8588213
[ Show all ]
Inchi KeyAHBXKUXNJSLOSD-UHFFFAOYSA-N
Inchi IDInChI=1S/C24H17N3O5S/c1-11-4-3-5-14(8-11)25-22(30)19-12(2)18-21(29)26-20(27-23(18)33-19)16-9-13-6-7-15(28)10-17(13)32-24(16)31/h3-10,28H,1-2H3,(H,25,30)(H,26,27,29)
PubChem CID135546934
ChEMBLCHEMBL1355684
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
557429Relaxin receptor 1Q9HBX9RXFP1Homo sapiens (Human)757

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