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Ligand

NameCHEMBL446925
Molecular formulaC17H21Cl2N3OS
IUPAC nameN-(2,4-dichlorophenyl)-2-(1-methyl-3,6-dihydro-2H-pyridin-5-yl)morpholine-4-carbothioamide
Molecular weight386.335
Hydrogen bond acceptor3
Hydrogen bond donor1
XlogP2.7
SynonymsBDBM50262219
N-(2,4-dichlorophenyl)-2-(1,2,5,6-tetrahydro-1-methylpyridin-3-yl)morpholine-4-carbothioamide
Inchi KeyAJQMZYILDVZKNE-UHFFFAOYSA-N
Inchi IDInChI=1S/C17H21Cl2N3OS/c1-21-6-2-3-12(10-21)16-11-22(7-8-23-16)17(24)20-15-5-4-13(18)9-14(15)19/h3-5,9,16H,2,6-8,10-11H2,1H3,(H,20,24)
PubChem CID44577947
ChEMBLCHEMBL446925
IUPHARN/A
BindingDB50262219
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
Page:  / 1 

GLASS IDNameUniProtGeneSpeciesLength
7135Muscarinic acetylcholine receptor M1P08482Chrm1Rattus norvegicus (Rat)460

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