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Ligand

NameCHEMBL3561130
Molecular formulaC19H18BrFN2O3S
IUPAC name(E)-1-[4-(4-bromophenyl)sulfonylpiperazin-1-yl]-3-(2-fluorophenyl)prop-2-en-1-one
Molecular weight453.326
Hydrogen bond acceptor5
Hydrogen bond donor0
XlogP3.2
SynonymsMLS-0472713.0001
SCHEMBL16599101
SCHEMBL16599105
Inchi KeyRUBVXNBXFNNLGN-BJMVGYQFSA-N
Inchi IDInChI=1S/C19H18BrFN2O3S/c20-16-6-8-17(9-7-16)27(25,26)23-13-11-22(12-14-23)19(24)10-5-15-3-1-2-4-18(15)21/h1-10H,11-14H2/b10-5+
PubChem CID26867513
ChEMBLCHEMBL3561130
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
500626G-protein coupled receptor 183P32249GPR183Homo sapiens (Human)361

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