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Ligand

NameSCHEMBL1280225
Molecular formulaC20H19N5O4
IUPAC name(10aS)-2-[1-[(3,5-dimethyl-1,2-oxazol-4-yl)methyl]pyrazol-4-yl]-7-hydroxy-10,10a-dihydro-5H-imidazo[1,5-b]isoquinoline-1,3-dione
Molecular weight393.403
Hydrogen bond acceptor6
Hydrogen bond donor1
XlogP1.2
SynonymsCHEMBL3964034
US9247759, 13-1
BDBM211442
GKWMOIYKDBXPST-SFHVURJKSA-N
(S)-2-(1-((3,5-dimethylisoxazol-4-yl)methyl)-1H-pyrazol-4-yl)-7-hydroxy-10,10a-dihydroimidazo[1,5-b]isoquinoline-1,3(2H,5H)-dione
Inchi KeyGKWMOIYKDBXPST-SFHVURJKSA-N
Inchi IDInChI=1S/C20H19N5O4/c1-11-17(12(2)29-22-11)10-23-9-15(7-21-23)25-19(27)18-6-13-3-4-16(26)5-14(13)8-24(18)20(25)28/h3-5,7,9,18,26H,6,8,10H2,1-2H3/t18-/m0/s1
PubChem CID53374870
ChEMBLCHEMBL3964034
IUPHARN/A
BindingDB211442
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
Page:  / 1 

GLASS IDNameUniProtGeneSpeciesLength
538428Taste receptor type 2 member 8Q9NYW2TAS2R8Homo sapiens (Human)309

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