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Ligand

NameCHEMBL1085875
Molecular formulaC19H18N4O4
IUPAC name2-[[3-[1-(5-hydroxypyridin-2-yl)pyrazol-3-yl]-2-methylpropanoyl]amino]benzoic acid
Molecular weight366.377
Hydrogen bond acceptor6
Hydrogen bond donor3
XlogP2.6
SynonymsBDBM50319255
2-(3-(1-(5-hydroxypyridin-2-yl)-1H-pyrazol-3-yl)-2-methylpropanamido)benzoicacid
Inchi KeyAMULEMYYQGJZNA-UHFFFAOYSA-N
Inchi IDInChI=1S/C19H18N4O4/c1-12(18(25)21-16-5-3-2-4-15(16)19(26)27)10-13-8-9-23(22-13)17-7-6-14(24)11-20-17/h2-9,11-12,24H,10H2,1H3,(H,21,25)(H,26,27)
PubChem CID46890197
ChEMBLCHEMBL1085875
IUPHARN/A
BindingDB50319255
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
9274Hydroxycarboxylic acid receptor 2Q8TDS4HCAR2Homo sapiens (Human)363

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