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Ligand

NameCHEMBL594838
Molecular formulaC15H17ClN2OS
IUPAC namemethyl (1Z,2S)-2-(4-chlorophenyl)-3-methyl-N-(1,3-thiazol-2-yl)butanimidate
Molecular weight308.824
Hydrogen bond acceptor4
Hydrogen bond donor0
XlogP4.9
Synonyms(S)-methyl 2-(4-chlorophenyl)-3-methyl-N-(thiazol-2-yl)butanimidate
BDBM50305937
Inchi KeyHDRMLSKXRFARLT-SSICXYGWSA-N
Inchi IDInChI=1S/C15H17ClN2OS/c1-10(2)13(11-4-6-12(16)7-5-11)14(19-3)18-15-17-8-9-20-15/h4-10,13H,1-3H3/b18-14-/t13-/m0/s1
PubChem CID46226436
ChEMBLCHEMBL594838
IUPHARN/A
BindingDB50305937
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
112268Free fatty acid receptor 2O15552FFAR2Homo sapiens (Human)330

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