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Ligand

NameCHEMBL300383
Molecular formulaC22H26N8O
IUPAC name1-[2-[4-[(1-methylbenzimidazol-2-yl)amino]piperidin-1-yl]ethyl]-4-phenyltetrazol-5-one
Molecular weight418.505
Hydrogen bond acceptor6
Hydrogen bond donor1
XlogP3.9
SynonymsN/A
Inchi KeyBPNAFOZKASJOCS-UHFFFAOYSA-N
Inchi IDInChI=1S/C22H26N8O/c1-27-20-10-6-5-9-19(20)24-21(27)23-17-11-13-28(14-12-17)15-16-29-22(31)30(26-25-29)18-7-3-2-4-8-18/h2-10,17H,11-16H2,1H3,(H,23,24)
PubChem CID12891605
ChEMBLCHEMBL300383
IUPHARN/A
BindingDBN/A
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
29702Histamine H1 receptorP31389HRH1Cavia porcellus (Guinea pig)488

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