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Ligand

Name1-Benzyl-2-(1-phenyl-1H-tetrazol-5-ylsulfanylmethyl)-1H-benzoimidazole
Molecular formulaC22H18N6S
IUPAC name1-benzyl-2-[(1-phenyltetrazol-5-yl)sulfanylmethyl]benzimidazole
Molecular weight398.488
Hydrogen bond acceptor5
Hydrogen bond donor0
XlogP4.7
SynonymsSMR000108168
BAS 00782406
AC1LL8JP
Oprea1_222736
Oprea1_762264
[ Show all ]
Inchi KeyAAMXDGPOCNFAOV-UHFFFAOYSA-N
Inchi IDInChI=1S/C22H18N6S/c1-3-9-17(10-4-1)15-27-20-14-8-7-13-19(20)23-21(27)16-29-22-24-25-26-28(22)18-11-5-2-6-12-18/h1-14H,15-16H2
PubChem CID1105872
ChEMBLCHEMBL1303226
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
351Neuropeptide S receptorQ6W5P4NPSR1Homo sapiens (Human)371

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