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Ligand

NameMLS000584180
Molecular formulaC18H15ClN2O2
IUPAC name2-chloro-3-[4-(dimethylamino)anilino]naphthalene-1,4-dione
Molecular weight326.78
Hydrogen bond acceptor4
Hydrogen bond donor1
XlogP3.3
Synonyms2-chloro-3-[4-(dimethylamino)anilino]naphthalene-1,4-dione
42262-96-4
SMR000203343
2-chloro-3-{[4-(dimethylamino)phenyl]amino}naphthoquinone
NSC92081
[ Show all ]
Inchi KeyIFCBGAQTKDYXAL-UHFFFAOYSA-N
Inchi IDInChI=1S/C18H15ClN2O2/c1-21(2)12-9-7-11(8-10-12)20-16-15(19)17(22)13-5-3-4-6-14(13)18(16)23/h3-10,20H,1-2H3
PubChem CID260557
ChEMBLCHEMBL1451772
IUPHARN/A
BindingDB34778
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
131723Galanin receptor type 2O43603GALR2Homo sapiens (Human)387
131722Glucagon-like peptide 1 receptorP43220GLP1RHomo sapiens (Human)463
131724Neuropeptide S receptorQ6W5P4NPSR1Homo sapiens (Human)371
479138Parathyroid hormone/parathyroid hormone-related peptide receptorQ03431PTH1RHomo sapiens (Human)593

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