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Ligand

NameCHEMBL3561867
Molecular formulaC20H18BrF3N2O3S
IUPAC name(E)-1-[4-(4-bromophenyl)sulfonylpiperazin-1-yl]-3-[2-(trifluoromethyl)phenyl]prop-2-en-1-one
Molecular weight503.334
Hydrogen bond acceptor7
Hydrogen bond donor0
XlogP4.0
SynonymsSBI-0646691.0001
SCHEMBL16598874
SCHEMBL16598877
Inchi KeyPCKLBGBPIIKUCN-BJMVGYQFSA-N
Inchi IDInChI=1S/C20H18BrF3N2O3S/c21-16-6-8-17(9-7-16)30(28,29)26-13-11-25(12-14-26)19(27)10-5-15-3-1-2-4-18(15)20(22,23)24/h1-10H,11-14H2/b10-5+
PubChem CID73330408
ChEMBLCHEMBL3561867
IUPHARN/A
BindingDBN/A
DrugBankN/A

Structure

SDF download

2D structure
Lipinski's druglikenessThis ligand is heavier than 500 daltons.

Known GPCRs

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Total entries: 1
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GLASS IDNameUniProtGeneSpeciesLength
494658G-protein coupled receptor 183P32249GPR183Homo sapiens (Human)361

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