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Ligand

NameCHEMBL3559978
Molecular formulaC20H21BrN2O3S
IUPAC name(E)-1-[4-(4-bromophenyl)sulfonylpiperazin-1-yl]-3-(2-methylphenyl)prop-2-en-1-one
Molecular weight449.363
Hydrogen bond acceptor4
Hydrogen bond donor0
XlogP3.5
SynonymsSCHEMBL16599120
SCHEMBL16599122
SBI-0646690.0001
Inchi KeyCEWMFCSXOXUMBL-IZZDOVSWSA-N
Inchi IDInChI=1S/C20H21BrN2O3S/c1-16-4-2-3-5-17(16)6-11-20(24)22-12-14-23(15-13-22)27(25,26)19-9-7-18(21)8-10-19/h2-11H,12-15H2,1H3/b11-6+
PubChem CID73330425
ChEMBLCHEMBL3559978
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
467867G-protein coupled receptor 183P32249GPR183Homo sapiens (Human)361

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