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Ligand

NameCHEMBL107083
Molecular formulaC14H19ClN4O2S
IUPAC nameN-[(4-chlorophenyl)methylsulfamoyl]-4-(1H-imidazol-5-yl)butan-1-amine
Molecular weight342.842
Hydrogen bond acceptor5
Hydrogen bond donor3
XlogP2.0
Synonyms[4-(4-Imidazolyl)butylamino](4-chlorobenzylamino) sulfone
BDBM50217238
L016923
Inchi KeyCKQJIDQDQRXNNF-UHFFFAOYSA-N
Inchi IDInChI=1S/C14H19ClN4O2S/c15-13-6-4-12(5-7-13)9-19-22(20,21)18-8-2-1-3-14-10-16-11-17-14/h4-7,10-11,18-19H,1-3,8-9H2,(H,16,17)
PubChem CID44214148
ChEMBLCHEMBL107083
IUPHARN/A
BindingDB50217238
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
44325Histamine H3 receptorQ9JI35HRH3Cavia porcellus (Guinea pig)445

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