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Ligand

NameCHEMBL1771388
Molecular formulaC22H30N4O2S
IUPAC nameN-cyclohexyl-7-[[2-methoxyethyl(methyl)amino]methyl]-N-(111C)methyl-[1,3]thiazolo[3,2-a]benzimidazole-2-carboxamide
Molecular weight413.568
Hydrogen bond acceptor5
Hydrogen bond donor0
XlogP4.6
SynonymsN/A
Inchi KeyAQINBUDFKZIGCN-JVVVGQRLSA-N
Inchi IDInChI=1S/C22H30N4O2S/c1-24(11-12-28-3)14-16-9-10-18-19(13-16)26-15-20(29-22(26)23-18)21(27)25(2)17-7-5-4-6-8-17/h9-10,13,15,17H,4-8,11-12,14H2,1-3H3/i2-1
PubChem CID54585457
ChEMBLCHEMBL1771388
IUPHARN/A
BindingDBN/A
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
11776Metabotropic glutamate receptor 1Q13255GRM1Homo sapiens (Human)1194

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