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Ligand

NameLopac-G-120
Molecular formulaC17H17N3O2
IUPAC name4-[(8R)-8-methyl-8,9-dihydro-7H-[1,3]dioxolo[4,5-h][2,3]benzodiazepin-5-yl]aniline
Molecular weight295.342
Hydrogen bond acceptor5
Hydrogen bond donor2
XlogP3.3
SynonymsCHEMBL1324434
ZINC3848
AJ-08182
NCGC00015464-01
Inchi KeyAQTITSBNGSVQNZ-SNVBAGLBSA-N
Inchi IDInChI=1S/C17H17N3O2/c1-10-6-12-7-15-16(22-9-21-15)8-14(12)17(20-19-10)11-2-4-13(18)5-3-11/h2-5,7-8,10,19H,6,9,18H2,1H3/t10-/m1/s1
PubChem CID6603855
ChEMBLCHEMBL1324434
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
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GLASS IDNameUniProtGeneSpeciesLength
12078Muscarinic acetylcholine receptor M1P08482Chrm1Rattus norvegicus (Rat)460

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