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Ligand

Name6-(isopropylamino)nicotinic acid
Molecular formulaC9H12N2O2
IUPAC name6-(propan-2-ylamino)pyridine-3-carboxylic acid
Molecular weight180.207
Hydrogen bond acceptor4
Hydrogen bond donor2
XlogP1.5
Synonyms6-[(propan-2-yl)amino]pyridine-3-carboxylic acid
F6146-0043
ZINC19844583
AKOS000213750
MCULE-4081168849
[ Show all ]
Inchi KeyORJYNQYULBKEFU-UHFFFAOYSA-N
Inchi IDInChI=1S/C9H12N2O2/c1-6(2)11-8-4-3-7(5-10-8)9(12)13/h3-6H,1-2H3,(H,10,11)(H,12,13)
PubChem CID28400003
ChEMBLCHEMBL394469
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
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GLASS IDNameUniProtGeneSpeciesLength
248575Hydroxycarboxylic acid receptor 3P49019HCAR3Homo sapiens (Human)387

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