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Ligand

NameCHEMBL1629856
Molecular formulaC25H22F3N3O
IUPAC name4-[3-(2-ethyl-6-methylpyridin-4-yl)phenyl]-7-methyl-8-(trifluoromethyl)-1,3-dihydro-1,5-benzodiazepin-2-one
Molecular weight437.466
Hydrogen bond acceptor6
Hydrogen bond donor1
XlogP5.5
SynonymsAFSJGBXRHLXBHV-UHFFFAOYSA-N
4-[3-(2-Ethyl-6-methyl-pyridin-4-yl)-phenyl]-7-methyl-8-trifluoromethyl-1,3-dihydro-benzo[b][1,4]diazepin-2-one
BDBM50332964
SCHEMBL5557475
4-(3-(2-ethyl-6-methylpyridin-4-yl)phenyl)-7-methyl-8-(trifluoromethyl)-1H-benzo[b][1,4]diazepin-2(3H)-one
Inchi KeyAFSJGBXRHLXBHV-UHFFFAOYSA-N
Inchi IDInChI=1S/C25H22F3N3O/c1-4-19-11-18(9-15(3)29-19)16-6-5-7-17(10-16)21-13-24(32)31-23-12-20(25(26,27)28)14(2)8-22(23)30-21/h5-12H,4,13H2,1-3H3,(H,31,32)
PubChem CID11351088
ChEMBLCHEMBL1629856
IUPHARN/A
BindingDB50332964
DrugBankN/A

Structure

SDF download

2D structure
Lipinski's druglikenessThis ligand has a partition coefficient log P greater than 5.

Known GPCRs

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Total entries: 2
Page:  / 1 

GLASS IDNameUniProtGeneSpeciesLength
4431Metabotropic glutamate receptor 2P31421Grm2Rattus norvegicus (Rat)872
557408Metabotropic glutamate receptor 2Q14416GRM2Homo sapiens (Human)872

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