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Ligand

NameCHEMBL2387687
Molecular formulaC17H17N3O2
IUPAC name2-[3,5-dimethyl-1-(quinolin-2-ylmethyl)pyrazol-4-yl]acetic acid
Molecular weight295.342
Hydrogen bond acceptor4
Hydrogen bond donor1
XlogP2.4
SynonymsBDBM50434460
Inchi KeyALZAQECZSXNSDU-UHFFFAOYSA-N
Inchi IDInChI=1S/C17H17N3O2/c1-11-15(9-17(21)22)12(2)20(19-11)10-14-8-7-13-5-3-4-6-16(13)18-14/h3-8H,9-10H2,1-2H3,(H,21,22)
PubChem CID71624848
ChEMBLCHEMBL2387687
IUPHARN/A
BindingDB50434460
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
8676Prostaglandin D2 receptor 2Q9Y5Y4PTGDR2Homo sapiens (Human)395

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