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Ligand

NameCHEMBL3986822
Molecular formulaC17H11ClF3N3O3S2
IUPAC nameN-[5-[(2-chlorophenyl)methylsulfonyl]-4-(trifluoromethyl)-1,3-thiazol-2-yl]pyridine-2-carboxamide
Molecular weight461.858
Hydrogen bond acceptor9
Hydrogen bond donor1
XlogP4.0
SynonymsBDBM192828
SCHEMBL12182169
US9192603, 1
Inchi KeyAMMFQNCXSHAZJB-UHFFFAOYSA-N
Inchi IDInChI=1S/C17H11ClF3N3O3S2/c18-11-6-2-1-5-10(11)9-29(26,27)15-13(17(19,20)21)23-16(28-15)24-14(25)12-7-3-4-8-22-12/h1-8H,9H2,(H,23,24,25)
PubChem CID54670967
ChEMBLCHEMBL3986822
IUPHARN/A
BindingDB192828
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
517364Metabotropic glutamate receptor 4Q14833GRM4Homo sapiens (Human)912

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