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Ligand

NameCHEMBL3560431
Molecular formulaC19H18FN3O5S
IUPAC name(E)-3-(4-fluorophenyl)-1-[4-(4-nitrophenyl)sulfonylpiperazin-1-yl]prop-2-en-1-one
Molecular weight419.427
Hydrogen bond acceptor7
Hydrogen bond donor0
XlogP2.4
SynonymsMLS-0472369.0001
SCHEMBL16599479
SCHEMBL16599481
Inchi KeyJCDSRLDTKQWUNX-XCVCLJGOSA-N
Inchi IDInChI=1S/C19H18FN3O5S/c20-16-4-1-15(2-5-16)3-10-19(24)21-11-13-22(14-12-21)29(27,28)18-8-6-17(7-9-18)23(25)26/h1-10H,11-14H2/b10-3+
PubChem CID26867780
ChEMBLCHEMBL3560431
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
481115G-protein coupled receptor 183P32249GPR183Homo sapiens (Human)361

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