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Ligand

Name3-hydroxy-1-(6-methylpyridin-2-yl)-5-[4-(propan-2-yl)phenyl]-4-(thiophen-2-ylcarbonyl)-1,5-dihydro-2H-pyrrol-2-one
Molecular formulaC24H22N2O3S
IUPAC name4-hydroxy-1-(6-methylpyridin-2-yl)-2-(4-propan-2-ylphenyl)-3-(thiophene-2-carbonyl)-2H-pyrrol-5-one
Molecular weight418.511
Hydrogen bond acceptor5
Hydrogen bond donor1
XlogP5.4
SynonymsAKOS005748410
Oprea1_514710
3-hydroxy-1-(6-methyl(2-pyridyl))-5-[4-(methylethyl)phenyl]-4-(2-thienylcarbon yl)-3-pyrrolin-2-one
CHEMBL1576217
STL148443
[ Show all ]
Inchi KeyDUJWEXPTWKQUEI-UHFFFAOYSA-N
Inchi IDInChI=1S/C24H22N2O3S/c1-14(2)16-9-11-17(12-10-16)21-20(22(27)18-7-5-13-30-18)23(28)24(29)26(21)19-8-4-6-15(3)25-19/h4-14,21,28H,1-3H3
PubChem CID3771682
ChEMBLCHEMBL1576217
IUPHARN/A
BindingDBN/A
DrugBankN/A

Structure

SDF download

2D structure
Lipinski's druglikenessThis ligand has a partition coefficient log P greater than 5.

Known GPCRs

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Total entries: 3
Page:  / 1 

GLASS IDNameUniProtGeneSpeciesLength
69126Relaxin receptor 1Q9HBX9RXFP1Homo sapiens (Human)757
69124Relaxin receptor 2Q8WXD0RXFP2Homo sapiens (Human)754
69125Vasopressin V1b receptorP47901AVPR1BHomo sapiens (Human)424

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