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Ligand

NameN-(4-methoxyphenyl)-4-(4-methyl-5-oxo-4,5-dihydrothieno[2,3-e][1,2,4]triazolo[4,3-a]pyrimidin-1-yl)butanamide
Molecular formulaC19H19N5O3S
IUPAC nameN-(4-methoxyphenyl)-4-(8-methyl-7-oxo-5-thia-1,8,10,11-tetrazatricyclo[7.3.0.02,6]dodeca-2(6),3,9,11-tetraen-12-yl)butanamide
Molecular weight397.453
Hydrogen bond acceptor6
Hydrogen bond donor1
XlogP2.0
SynonymsAKOS001915440
SMR000628764
HMS2958I08
MolPort-003-071-422
STL135069
[ Show all ]
Inchi KeyGURKTFXEGDYMIT-UHFFFAOYSA-N
Inchi IDInChI=1S/C19H19N5O3S/c1-23-18(26)17-14(10-11-28-17)24-15(21-22-19(23)24)4-3-5-16(25)20-12-6-8-13(27-2)9-7-12/h6-11H,3-5H2,1-2H3,(H,20,25)
PubChem CID7184632
ChEMBLCHEMBL1550958
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: 3
Page:  / 1 

GLASS IDNameUniProtGeneSpeciesLength
105866Relaxin receptor 1Q9HBX9RXFP1Homo sapiens (Human)757
105868Relaxin receptor 2Q8WXD0RXFP2Homo sapiens (Human)754
105867Vasopressin V1b receptorP47901AVPR1BHomo sapiens (Human)424

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