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Ligand

NameCHEMBL3560117
Molecular formulaC23H23FN2O3S
IUPAC name(E)-1-[4-(3,4-dihydronaphthalen-2-ylsulfonyl)piperazin-1-yl]-3-(4-fluorophenyl)prop-2-en-1-one
Molecular weight426.506
Hydrogen bond acceptor5
Hydrogen bond donor0
XlogP3.3
SynonymsSCHEMBL16599046
MLS-0472417.0001
SCHEMBL16599042
Inchi KeyQMQWSXVJKRGTCR-KPKJPENVSA-N
Inchi IDInChI=1S/C23H23FN2O3S/c24-21-9-5-18(6-10-21)7-12-23(27)25-13-15-26(16-14-25)30(28,29)22-11-8-19-3-1-2-4-20(19)17-22/h1-7,9-10,12,17H,8,11,13-16H2/b12-7+
PubChem CID71295857
ChEMBLCHEMBL3560117
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
497833G-protein coupled receptor 183P32249GPR183Homo sapiens (Human)361

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