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Ligand

NameCHEMBL3299016
Molecular formulaC19H17ClN2O3
IUPAC name2-[[(E)-3-(2-chloroquinolin-3-yl)prop-2-enoyl]amino]cyclohexene-1-carboxylic acid
Molecular weight356.806
Hydrogen bond acceptor4
Hydrogen bond donor2
XlogP4.3
SynonymsBDBM50022069
Inchi KeyIGTQKGWKKCOSPJ-MDZDMXLPSA-N
Inchi IDInChI=1S/C19H17ClN2O3/c20-18-13(11-12-5-1-3-7-15(12)22-18)9-10-17(23)21-16-8-4-2-6-14(16)19(24)25/h1,3,5,7,9-11H,2,4,6,8H2,(H,21,23)(H,24,25)/b10-9+
PubChem CID90645407
ChEMBLCHEMBL3299016
IUPHARN/A
BindingDB50022069
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: 3
Page:  / 1 

GLASS IDNameUniProtGeneSpeciesLength
132886Hydroxycarboxylic acid receptor 1Q9BXC0HCAR1Homo sapiens (Human)346
132885Hydroxycarboxylic acid receptor 2Q8TDS4HCAR2Homo sapiens (Human)363
132887Hydroxycarboxylic acid receptor 3P49019HCAR3Homo sapiens (Human)387

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