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Ligand

NameMLS000043821
Molecular formulaC16H11ClFN5O
IUPAC name4-[1-[(2-chloro-4-fluorophenyl)methyl]benzimidazol-2-yl]-1,2,5-oxadiazol-3-amine
Molecular weight343.746
Hydrogen bond acceptor6
Hydrogen bond donor1
XlogP2.9
SynonymsSMR000021032
4-[1-(2-Chloro-4-fluorobenzyl)-1H-benzimidazol-2-yl]-1,2,5-oxadiazol-3-amine
4-[1-[(2-chloro-4-fluorophenyl)methyl]benzimidazol-2-yl]-1,2,5-oxadiazol-3-amine
AC1LBTJD
TimTec1_003735
[ Show all ]
Inchi KeyAOLLHGYQIPWYEK-UHFFFAOYSA-N
Inchi IDInChI=1S/C16H11ClFN5O/c17-11-7-10(18)6-5-9(11)8-23-13-4-2-1-3-12(13)20-16(23)14-15(19)22-24-21-14/h1-7H,8H2,(H2,19,22)
PubChem CID588745
ChEMBLCHEMBL1390396
IUPHARN/A
BindingDB37418
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: 4
Page:  / 1 

GLASS IDNameUniProtGeneSpeciesLength
10336Glucagon-like peptide 1 receptorP43220GLP1RHomo sapiens (Human)463
464141Parathyroid hormone/parathyroid hormone-related peptide receptorQ03431PTH1RHomo sapiens (Human)593
10338Sphingosine 1-phosphate receptor 3Q99500S1PR3Homo sapiens (Human)378
10337Thyrotropin receptorP16473TSHRHomo sapiens (Human)764

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