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Ligand

NameAC1ME3YV
Molecular formulaC14H20N2O2
IUPAC name5,6-dimethyl-8-(2-methylprop-1-enyl)-2,3,4a,5,8,8a-hexahydrophthalazine-1,4-dione
Molecular weight248.326
Hydrogen bond acceptor2
Hydrogen bond donor2
XlogP1.6
Synonyms5,6-dimethyl-8-(2-methylprop-1-enyl)-2,3,4a,5,8,8a-hexahydrophthalazine-1,4-dione
MCULE-6840088666
BAS 00459067
SMR000140419
5,6-dimethyl-8-(2-methyl-1-propen-1-yl)-2,3,4a,5,8,8a-hexahydro-1,4-phthalazinedione
[ Show all ]
Inchi KeyAGFYVJCJRQPJIS-UHFFFAOYSA-N
Inchi IDInChI=1S/C14H20N2O2/c1-7(2)5-10-6-8(3)9(4)11-12(10)14(18)16-15-13(11)17/h5-6,9-12H,1-4H3,(H,15,17)(H,16,18)
PubChem CID2847622
ChEMBLCHEMBL1459997
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
4845Neuropeptide S receptorQ6W5P4NPSR1Homo sapiens (Human)371

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