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Ligand

NameCHEMBL3560529
Molecular formulaC19H18BrFN2O3S
IUPAC name(E)-1-[4-(2-bromophenyl)sulfonylpiperazin-1-yl]-3-(4-fluorophenyl)prop-2-en-1-one
Molecular weight453.326
Hydrogen bond acceptor5
Hydrogen bond donor0
XlogP3.2
SynonymsSCHEMBL16598726
AKOS007977095
MLS-0472449.0001
ZINC24956639
SCHEMBL16598724
Inchi KeyUISFJYRMDDPHRD-JXMROGBWSA-N
Inchi IDInChI=1S/C19H18BrFN2O3S/c20-17-3-1-2-4-18(17)27(25,26)23-13-11-22(12-14-23)19(24)10-7-15-5-8-16(21)9-6-15/h1-10H,11-14H2/b10-7+
PubChem CID32268755
ChEMBLCHEMBL3560529
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
504656G-protein coupled receptor 183P32249GPR183Homo sapiens (Human)361

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