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Ligand

NameCHEMBL523945
Molecular formulaC17H13F2N5S
IUPAC name3-[(4S,5S)-5-(4-fluorophenyl)-5-(6-fluoropyridin-3-yl)-4-methyl-1,4-dihydroimidazol-2-yl]-1,2,5-thiadiazole
Molecular weight357.383
Hydrogen bond acceptor7
Hydrogen bond donor1
XlogP2.5
SynonymsBDBM50249865
SCHEMBL4456753
2-Fluoro-5-[(4S,5S)-4-(4-fluorophenyl)-5-methyl-2-(1,2,5-thiadiazol-3-yl)-4,5-dihydro-1H-imidazol-4-yl]pyridine
Inchi KeyAGUSBSWEUMEPIM-BTDLBPIBSA-N
Inchi IDInChI=1S/C17H13F2N5S/c1-10-17(11-2-5-13(18)6-3-11,12-4-7-15(19)20-8-12)23-16(22-10)14-9-21-25-24-14/h2-10H,1H3,(H,22,23)/t10-,17-/m0/s1
PubChem CID44139602
ChEMBLCHEMBL523945
IUPHARN/A
BindingDB50249865
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
5227Neuropeptide Y receptor type 5Q15761NPY5RHomo sapiens (Human)445

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