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Ligand

NameNCGC00016051-01
Molecular formulaC13H8N4O3
IUPAC name(3Z)-3-amino-4-(3,4,5-trihydroxyphenyl)buta-1,3-diene-1,1,4-tricarbonitrile
Molecular weight268.232
Hydrogen bond acceptor7
Hydrogen bond donor4
XlogP0.2
SynonymsLopac-T-7665
NCGC00094473-02
CCG-205305
SR-01000076175-1
EU-0101231
[ Show all ]
Inchi KeyAURCEVGZZLSFSU-MDZDMXLPSA-N
Inchi IDInChI=1S/C13H8N4O3/c14-4-7(5-15)1-10(17)9(6-16)8-2-11(18)13(20)12(19)3-8/h1-3,18-20H,17H2/b10-9+
PubChem CID6604029
ChEMBLCHEMBL1376723
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: 3
Page:  / 1 

GLASS IDNameUniProtGeneSpeciesLength
14911D(1A) dopamine receptorP21728DRD1Homo sapiens (Human)446
14910Muscarinic acetylcholine receptor M1P08482Chrm1Rattus norvegicus (Rat)460
14912Neuropeptide S receptorQ6W5P4NPSR1Homo sapiens (Human)371

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