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Ligand

NameCHEMBL461673
Molecular formulaC18H21FN4O2
IUPAC nametert-butyl 4-[1-(2-fluorophenyl)triazol-4-yl]-3,6-dihydro-2H-pyridine-1-carboxylate
Molecular weight344.39
Hydrogen bond acceptor5
Hydrogen bond donor0
XlogP2.5
SynonymsBDBM50273829
GFWSBYBQNHQKCS-UHFFFAOYSA-N
tert-Butyl-4-[1-(2-fluorophenyl)-1H-1,2,3-triazol-4-yl]-3,6-dihydropyridine-1(2H)-carboxylate
SCHEMBL12975497
tert-Butyl 4-[1-(2-fluorophenyl)-1H-[1,2,3]triazol-4-yl]-1,2,3,6-tetrahydropyridine-1-carboxylate
Inchi KeyGFWSBYBQNHQKCS-UHFFFAOYSA-N
Inchi IDInChI=1S/C18H21FN4O2/c1-18(2,3)25-17(24)22-10-8-13(9-11-22)15-12-23(21-20-15)16-7-5-4-6-14(16)19/h4-8,12H,9-11H2,1-3H3
PubChem CID44588385
ChEMBLCHEMBL461673
IUPHARN/A
BindingDB50273829
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: 3
Page:  / 1 

GLASS IDNameUniProtGeneSpeciesLength
95436Metabotropic glutamate receptor 1Q13255GRM1Homo sapiens (Human)1194
95437Metabotropic glutamate receptor 1P97772Grm1Mus musculus (Mouse)1199
95435Metabotropic glutamate receptor 5P41594GRM5Homo sapiens (Human)1212

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