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Ligand

NameAC1M2LTZ
Molecular formulaC21H19N3O5S
IUPAC name[2-(3-nitroanilino)-2-oxoethyl] 2-[2-methyl-4-(4-methylphenyl)-1,3-thiazol-5-yl]acetate
Molecular weight425.459
Hydrogen bond acceptor7
Hydrogen bond donor1
XlogP3.9
SynonymsMCULE-9157027598
SMR000253364
CHEMBL1423949
[(3-nitrophenyl)carbamoyl]methyl 2-[2-methyl-4-(4-methylphenyl)-1,3-thiazol-5-yl]acetate
MLS000335610
[ Show all ]
Inchi KeyAEYFOOLBTNGWRK-UHFFFAOYSA-N
Inchi IDInChI=1S/C21H19N3O5S/c1-13-6-8-15(9-7-13)21-18(30-14(2)22-21)11-20(26)29-12-19(25)23-16-4-3-5-17(10-16)24(27)28/h3-10H,11-12H2,1-2H3,(H,23,25)
PubChem CID2119540
ChEMBLCHEMBL1423949
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
Page:  / 1 

GLASS IDNameUniProtGeneSpeciesLength
463364Parathyroid hormone/parathyroid hormone-related peptide receptorQ03431PTH1RHomo sapiens (Human)593

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