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Ligand

NameMLS001141336
Molecular formulaC24H26ClN3O4
IUPAC name6-[(10aS)-1,3-dioxo-10,10a-dihydro-5H-imidazo[1,5-b]isoquinolin-2-yl]-N-(3-chloro-4-methoxyphenyl)hexanamide
Molecular weight455.939
Hydrogen bond acceptor4
Hydrogen bond donor1
XlogP3.4
SynonymsMolPort-002-660-555
STK573161
MCULE-1435128825
1013752-21-0
N-(3-chloro-4-methoxyphenyl)-6-[(10aS)-1,3-dioxo-1,5,10,10a-tetrahydroimidazo[1,5-b]isoquinolin-2(3H)-yl]hexanamide
[ Show all ]
Inchi KeyAAVKSUJJSADYEN-FQEVSTJZSA-N
Inchi IDInChI=1S/C24H26ClN3O4/c1-32-21-11-10-18(14-19(21)25)26-22(29)9-3-2-6-12-27-23(30)20-13-16-7-4-5-8-17(16)15-28(20)24(27)31/h4-5,7-8,10-11,14,20H,2-3,6,9,12-13,15H2,1H3,(H,26,29)/t20-/m0/s1
PubChem CID17580921
ChEMBLCHEMBL1299752
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
Page:  / 1 

GLASS IDNameUniProtGeneSpeciesLength
463020Parathyroid hormone/parathyroid hormone-related peptide receptorQ03431PTH1RHomo sapiens (Human)593

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