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Ligand

NameAC1ONPYM
Molecular formulaC15H18BrN3OS
IUPAC name1-[4-(6-bromo-1,3-benzothiazol-2-yl)piperazin-1-yl]butan-1-one
Molecular weight368.293
Hydrogen bond acceptor4
Hydrogen bond donor0
XlogP3.6
SynonymsMLS001167476
CHEMBL1583107
MolPort-003-142-297
HMS2956G14
ZINC5181375
[ Show all ]
Inchi KeyAGWYHHIZNNZZSG-UHFFFAOYSA-N
Inchi IDInChI=1S/C15H18BrN3OS/c1-2-3-14(20)18-6-8-19(9-7-18)15-17-12-5-4-11(16)10-13(12)21-15/h4-5,10H,2-3,6-9H2,1H3
PubChem CID7539178
ChEMBLCHEMBL1583107
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
463520Parathyroid hormone/parathyroid hormone-related peptide receptorQ03431PTH1RHomo sapiens (Human)593

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