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Ligand

NameCHEMBL469758
Molecular formulaC21H15ClN2O4
IUPAC name2-[(6-chloro-1,3-benzodioxol-5-yl)oxymethyl]-6-phenoxy-1H-benzimidazole
Molecular weight394.811
Hydrogen bond acceptor5
Hydrogen bond donor1
XlogP5.0
Synonyms2-((6-chlorobenzo[d][1,3]dioxol-5-yloxy)methyl)-6-phenoxy-1H-benzo[d]imidazole
BDBM50275901
Inchi KeyDZQKZWZLOFJGGW-UHFFFAOYSA-N
Inchi IDInChI=1S/C21H15ClN2O4/c22-15-9-19-20(27-12-26-19)10-18(15)25-11-21-23-16-7-6-14(8-17(16)24-21)28-13-4-2-1-3-5-13/h1-10H,11-12H2,(H,23,24)
PubChem CID44589982
ChEMBLCHEMBL469758
IUPHARN/A
BindingDB50275901
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
72940Bombesin receptor subtype-3P32247BRS3Homo sapiens (Human)399

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