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Ligand

NameCHEMBL3299115
Molecular formulaC18H19NO5
IUPAC name2-[[(E)-3-(2,3-dihydro-1,4-benzodioxin-6-yl)prop-2-enoyl]amino]cyclohexene-1-carboxylic acid
Molecular weight329.352
Hydrogen bond acceptor5
Hydrogen bond donor2
XlogP2.8
SynonymsBDBM50022070
Inchi KeyAEQNNQKJUBKOBX-SOFGYWHQSA-N
Inchi IDInChI=1S/C18H19NO5/c20-17(19-14-4-2-1-3-13(14)18(21)22)8-6-12-5-7-15-16(11-12)24-10-9-23-15/h5-8,11H,1-4,9-10H2,(H,19,20)(H,21,22)/b8-6+
PubChem CID90645408
ChEMBLCHEMBL3299115
IUPHARN/A
BindingDB50022070
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: 2
Page:  / 1 

GLASS IDNameUniProtGeneSpeciesLength
3759Hydroxycarboxylic acid receptor 2Q8TDS4HCAR2Homo sapiens (Human)363
3760Hydroxycarboxylic acid receptor 3P49019HCAR3Homo sapiens (Human)387

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