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Ligand

NameCHEMBL453249
Molecular formulaC17H21N5O2
IUPAC nametert-butyl 4-(1-pyridin-3-yltriazol-4-yl)-3,6-dihydro-2H-pyridine-1-carboxylate
Molecular weight327.388
Hydrogen bond acceptor5
Hydrogen bond donor0
XlogP1.4
SynonymsBDBM50273896
tert-Butyl-4-[1-pyridin-3-yl-1 H-1,2,3-triazol-4-yl]-3,6-dihydropyridine-1(2H)-carboxylate
BZAKDBCUMWDPGV-UHFFFAOYSA-N
SCHEMBL12975527
tert-Butyl 4-[1-(pyridin-3-yl)-1H-[1,2,3]triazol-4-yl]-1,2,3,6-tetrahydropyridine-1-carboxylate
Inchi KeyBZAKDBCUMWDPGV-UHFFFAOYSA-N
Inchi IDInChI=1S/C17H21N5O2/c1-17(2,3)24-16(23)21-9-6-13(7-10-21)15-12-22(20-19-15)14-5-4-8-18-11-14/h4-6,8,11-12H,7,9-10H2,1-3H3
PubChem CID44588461
ChEMBLCHEMBL453249
IUPHARN/A
BindingDB50273896
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
36254Metabotropic glutamate receptor 1Q13255GRM1Homo sapiens (Human)1194
36255Metabotropic glutamate receptor 1P97772Grm1Mus musculus (Mouse)1199
36256Metabotropic glutamate receptor 5P41594GRM5Homo sapiens (Human)1212

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