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Ligand

NameCHEMBL420892
Molecular formulaC14H16N2O3
IUPAC nameethyl 4-[2-(1H-imidazol-5-yl)ethoxy]benzoate
Molecular weight260.293
Hydrogen bond acceptor4
Hydrogen bond donor1
XlogP2.2
Synonyms4-[2-(1H-Imidazol-4-yl)-ethoxy]-benzoic acid ethyl ester
4-[2-(1H-Imidazol-4-yl)ethoxy]benzoic acid ethyl ester
4-[2-(4-Ethoxycarbonylphenoxy)ethyl]-1H-imidazole
ABPLWFSNNTVIKC-UHFFFAOYSA-N
BDBM50053281
[ Show all ]
Inchi KeyABPLWFSNNTVIKC-UHFFFAOYSA-N
Inchi IDInChI=1S/C14H16N2O3/c1-2-18-14(17)11-3-5-13(6-4-11)19-8-7-12-9-15-10-16-12/h3-6,9-10H,2,7-8H2,1H3,(H,15,16)
PubChem CID10848915
ChEMBLCHEMBL420892
IUPHARN/A
BindingDB50053281
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
1058Histamine H3 receptorQ9QYN8Hrh3Rattus norvegicus (Rat)445

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