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Ligand

NameCHEMBL593606
Molecular formulaC23H19Cl2F2N3S
IUPAC name5,6-bis(4-chlorophenyl)-N-(4,4-difluorocyclohexyl)pyrazine-2-carbothioamide
Molecular weight478.383
Hydrogen bond acceptor5
Hydrogen bond donor1
XlogP6.5
Synonyms5,6-bis(4-chlorophenyl)-N-(4,4-difluorocyclohexyl)pyrazine-2-carbothioamide
BDBM50305987
Inchi KeyAGNDHMNUEJDYLS-UHFFFAOYSA-N
Inchi IDInChI=1S/C23H19Cl2F2N3S/c24-16-5-1-14(2-6-16)20-21(15-3-7-17(25)8-4-15)30-19(13-28-20)22(31)29-18-9-11-23(26,27)12-10-18/h1-8,13,18H,9-12H2,(H,29,31)
PubChem CID46226165
ChEMBLCHEMBL593606
IUPHARN/A
BindingDB50305987
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: 1
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GLASS IDNameUniProtGeneSpeciesLength
5041Cannabinoid receptor 1P21554CNR1Homo sapiens (Human)472

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