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Ligand

NameMLS001028787
Molecular formulaC23H25N5O2S
IUPAC name2-[3,4-dimethyl-2-(4-methylphenyl)-7-oxopyrazolo[3,4-d]pyridazin-6-yl]-N-(2-thiophen-2-ylethyl)propanamide
Molecular weight435.546
Hydrogen bond acceptor5
Hydrogen bond donor1
XlogP3.7
SynonymsAKOS021938410
SMR000629834
HMS2961I17
2-[3,4-dimethyl-2-(4-methylphenyl)-7-oxo-2,7-dihydro-6H-pyrazolo[3,4-d]pyridazin-6-yl]-N-(2-thien-2-ylethyl)propanamide
MolPort-007-767-203
[ Show all ]
Inchi KeyAHHKYZOLGMQZAZ-UHFFFAOYSA-N
Inchi IDInChI=1S/C23H25N5O2S/c1-14-7-9-18(10-8-14)27-16(3)20-15(2)25-28(23(30)21(20)26-27)17(4)22(29)24-12-11-19-6-5-13-31-19/h5-10,13,17H,11-12H2,1-4H3,(H,24,29)
PubChem CID20919877
ChEMBLCHEMBL1328230
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: 2
Page:  / 1 

GLASS IDNameUniProtGeneSpeciesLength
5552Glucagon-like peptide 1 receptorP43220GLP1RHomo sapiens (Human)463
463555Parathyroid hormone/parathyroid hormone-related peptide receptorQ03431PTH1RHomo sapiens (Human)593

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