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Ligand

Namemethyl 4-((2-(4-fluorobenzoyl)-6,7-dimethoxy-1,2,3,4-tetrahydroisoquinolin-1-yl)methoxy)benzoate
Molecular formulaC27H26FNO6
IUPAC namemethyl 4-[[2-(4-fluorobenzoyl)-6,7-dimethoxy-3,4-dihydro-1H-isoquinolin-1-yl]methoxy]benzoate
Molecular weight479.504
Hydrogen bond acceptor7
Hydrogen bond donor0
XlogP4.5
Synonymsmethyl 4-{[2-(4-fluorobenzoyl)-6,7-dimethoxy-1,2,3,4-tetrahydroisoquinolin-1-yl]methoxy}benzoate
AC1MTSGU
Oprea1_212067
CHEMBL1593053
MolPort-003-022-022
[ Show all ]
Inchi KeyADKUCHZMQHXGKC-UHFFFAOYSA-N
Inchi IDInChI=1S/C27H26FNO6/c1-32-24-14-19-12-13-29(26(30)17-4-8-20(28)9-5-17)23(22(19)15-25(24)33-2)16-35-21-10-6-18(7-11-21)27(31)34-3/h4-11,14-15,23H,12-13,16H2,1-3H3
PubChem CID3607140
ChEMBLCHEMBL1593053
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
463218Parathyroid hormone/parathyroid hormone-related peptide receptorQ03431PTH1RHomo sapiens (Human)593

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