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Ligand

NameCHEMBL105495
Molecular formulaC17H25ClN4O2S
IUPAC nameN-[(4-chlorophenyl)methylsulfamoyl]-7-(1H-imidazol-5-yl)heptan-1-amine
Molecular weight384.923
Hydrogen bond acceptor5
Hydrogen bond donor3
XlogP3.5
SynonymsBDBM50217242
Inchi KeyBGMIWORIAHINBP-UHFFFAOYSA-N
Inchi IDInChI=1S/C17H25ClN4O2S/c18-16-9-7-15(8-10-16)12-22-25(23,24)21-11-5-3-1-2-4-6-17-13-19-14-20-17/h7-10,13-14,21-22H,1-6,11-12H2,(H,19,20)
PubChem CID44335873
ChEMBLCHEMBL105495
IUPHARN/A
BindingDB50217242
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
23133Histamine H3 receptorQ9JI35HRH3Cavia porcellus (Guinea pig)445

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