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Ligand

NameCHEMBL68764
Molecular formulaC17H25N3O2S
IUPAC name4-tert-butyl-N-[4-(1H-imidazol-5-yl)butyl]benzenesulfonamide
Molecular weight335.466
Hydrogen bond acceptor4
Hydrogen bond donor2
XlogP3.4
SynonymsBDBM50071356
SCHEMBL8314642
4-tert-Butyl-N-[4-(1H-imidazol-4-yl)-butyl]-benzenesulfonamide
Inchi KeyAQPCMVKDEWVILC-UHFFFAOYSA-N
Inchi IDInChI=1S/C17H25N3O2S/c1-17(2,3)14-7-9-16(10-8-14)23(21,22)20-11-5-4-6-15-12-18-13-19-15/h7-10,12-13,20H,4-6,11H2,1-3H3,(H,18,19)
PubChem CID10359599
ChEMBLCHEMBL68764
IUPHARN/A
BindingDB50071356
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: 2
Page:  / 1 

GLASS IDNameUniProtGeneSpeciesLength
11985Histamine H1 receptorP31389HRH1Cavia porcellus (Guinea pig)488
11984Histamine H3 receptorQ9JI35HRH3Cavia porcellus (Guinea pig)445

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