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Ligand

NameCHEMBL1086356
Molecular formulaC20H21NO5
IUPAC name5-hydroxy-2-[3-(6-hydroxynaphthalen-2-yl)propanoylamino]cyclohexene-1-carboxylic acid
Molecular weight355.39
Hydrogen bond acceptor5
Hydrogen bond donor4
XlogP2.6
SynonymsBDBM50319098
5-hydroxy-2-(3-(6-hydroxynaphthalen-2-yl)propanamido)cyclohex-1-enecarboxylic acid
Inchi KeyCIQTZWSZWNISGL-UHFFFAOYSA-N
Inchi IDInChI=1S/C20H21NO5/c22-15-5-4-13-9-12(1-3-14(13)10-15)2-8-19(24)21-18-7-6-16(23)11-17(18)20(25)26/h1,3-5,9-10,16,22-23H,2,6-8,11H2,(H,21,24)(H,25,26)
PubChem CID46890271
ChEMBLCHEMBL1086356
IUPHARN/A
BindingDB50319098
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
42908Hydroxycarboxylic acid receptor 2Q8TDS4HCAR2Homo sapiens (Human)363

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