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Ligand

NameMLS000574219
Molecular formulaC18H13ClN2O3
IUPAC name4-chloro-3-(2,5-dioxopyrrol-1-yl)-N-(4-methylphenyl)benzamide
Molecular weight340.763
Hydrogen bond acceptor3
Hydrogen bond donor1
XlogP2.9
Synonyms3-[2,5-bis(oxidanylidene)pyrrol-1-yl]-4-chloranyl-N-(4-methylphenyl)benzamide
4-chloro-3-(2,5-dioxo-1-pyrrolyl)-N-(4-methylphenyl)benzamide
4-chloro-3-(2,5-dioxo-2,5-dihydro-1H-pyrrol-1-yl)-N-(4-methylphenyl)benzamide
4-chloro-3-(2,5-dioxopyrrol-1-yl)-N-(4-methylphenyl)benzamide
4-chloro-3-maleimido-N-(p-tolyl)benzamide
[ Show all ]
Inchi KeyACSISLCYYDRVIM-UHFFFAOYSA-N
Inchi IDInChI=1S/C18H13ClN2O3/c1-11-2-5-13(6-3-11)20-18(24)12-4-7-14(19)15(10-12)21-16(22)8-9-17(21)23/h2-10H,1H3,(H,20,24)
PubChem CID885550
ChEMBLCHEMBL1447350
IUPHARN/A
BindingDB66051
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: 4
Page:  / 1 

GLASS IDNameUniProtGeneSpeciesLength
1875C-C chemokine receptor type 6P51684CCR6Homo sapiens (Human)374
1873Glucagon-like peptide 1 receptorP43220GLP1RHomo sapiens (Human)463
1874Neuropeptide S receptorQ6W5P4NPSR1Homo sapiens (Human)371
463170Parathyroid hormone/parathyroid hormone-related peptide receptorQ03431PTH1RHomo sapiens (Human)593

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