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Ligand

NameCHEMBL1085148
Molecular formulaC19H22N4O4
IUPAC name2-[3-[1-(5-hydroxypyridin-2-yl)-5-methylpyrazol-4-yl]propanoylamino]cyclohexene-1-carboxylic acid
Molecular weight370.409
Hydrogen bond acceptor6
Hydrogen bond donor3
XlogP2.1
SynonymsBDBM50319252
2-(3-(1-(5-hydroxypyridin-2-yl)-5-methyl-1H-pyrazol-4-yl)propanamido)cyclohex-1-enecarboxylicacid
Inchi KeyBHCQOIZYOBQROQ-UHFFFAOYSA-N
Inchi IDInChI=1S/C19H22N4O4/c1-12-13(10-21-23(12)17-8-7-14(24)11-20-17)6-9-18(25)22-16-5-3-2-4-15(16)19(26)27/h7-8,10-11,24H,2-6,9H2,1H3,(H,22,25)(H,26,27)
PubChem CID46890237
ChEMBLCHEMBL1085148
IUPHARN/A
BindingDB50319252
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
23633Hydroxycarboxylic acid receptor 2Q8TDS4HCAR2Homo sapiens (Human)363

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