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Ligand

NameCHEMBL279875
Molecular formulaC18H24N4O
IUPAC name2-(4-methyl-1,4-diazepan-1-yl)-1-(2-prop-2-ynoxyethyl)benzimidazole
Molecular weight312.417
Hydrogen bond acceptor4
Hydrogen bond donor0
XlogP2.0
Synonyms2-(4-methyl-1,4-diazepan-1-yl)-1-(2-prop-2-ynoxyethyl)benzimidazole
AC1MIJLL
2-(4-Methyl-[1,4]diazepan-1-yl)-1-(2-prop-2-ynyloxy-ethyl)-1H-benzoimidazole
BDBM50019609
SCHEMBL10925227
Inchi KeyBZCFHXGGWYZWHL-UHFFFAOYSA-N
Inchi IDInChI=1S/C18H24N4O/c1-3-14-23-15-13-22-17-8-5-4-7-16(17)19-18(22)21-10-6-9-20(2)11-12-21/h1,4-5,7-8H,6,9-15H2,2H3
PubChem CID3070998
ChEMBLCHEMBL279875
IUPHARN/A
BindingDB50019609
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
36318Histamine H1 receptorP31389HRH1Cavia porcellus (Guinea pig)488

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