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Ligand

NameCHEMBL346389
Molecular formulaC19H20ClN3O2
IUPAC name7-[[4-(4-chlorophenyl)piperazin-1-yl]methyl]-4H-1,4-benzoxazin-3-one
Molecular weight357.838
Hydrogen bond acceptor4
Hydrogen bond donor1
XlogP2.9
SynonymsSCHEMBL6910062
BDBM50083342
CI-1030
7-[4-(4-Chloro-phenyl)-piperazin-1-ylmethyl]-4H-benzo[1,4]oxazin-3-one
ZINC53057273
[ Show all ]
Inchi KeyUFFHNEZNXKJHFB-UHFFFAOYSA-N
Inchi IDInChI=1S/C19H20ClN3O2/c20-15-2-4-16(5-3-15)23-9-7-22(8-10-23)12-14-1-6-17-18(11-14)25-13-19(24)21-17/h1-6,11H,7-10,12-13H2,(H,21,24)
PubChem CID9885114
ChEMBLCHEMBL346389
IUPHARN/A
BindingDB50083342
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: 9
Page:  / 1 

GLASS IDNameUniProtGeneSpeciesLength
3354355-hydroxytryptamine receptor 1AP08908HTR1AHomo sapiens (Human)422
335436Alpha-1A adrenergic receptorP43140Adra1aRattus norvegicus (Rat)466
335440Alpha-1B adrenergic receptorP15823Adra1bRattus norvegicus (Rat)515
335441Alpha-2A adrenergic receptorP08913ADRA2AHomo sapiens (Human)450
335442Alpha-2B adrenergic receptorP19328Adra2bRattus norvegicus (Rat)453
335437D(2) dopamine receptorP14416DRD2Homo sapiens (Human)443
335439D(3) dopamine receptorP35462DRD3Homo sapiens (Human)400
335438D(4) dopamine receptorP21917DRD4Homo sapiens (Human)467
335443Muscarinic acetylcholine receptor M5P08912CHRM5Homo sapiens (Human)532

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