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Ligand

NameCHEMBL3561595
Molecular formulaC19H18ClFN2O3S
IUPAC name(E)-1-[4-(benzenesulfonyl)piperazin-1-yl]-3-(4-chloro-2-fluorophenyl)prop-2-en-1-one
Molecular weight408.872
Hydrogen bond acceptor5
Hydrogen bond donor0
XlogP3.2
SynonymsSCHEMBL16598959
SCHEMBL16598963
SBI-0646682.0001
Inchi KeyJHWZJIMSODDXRY-VQHVLOKHSA-N
Inchi IDInChI=1S/C19H18ClFN2O3S/c20-16-8-6-15(18(21)14-16)7-9-19(24)22-10-12-23(13-11-22)27(25,26)17-4-2-1-3-5-17/h1-9,14H,10-13H2/b9-7+
PubChem CID73330411
ChEMBLCHEMBL3561595
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
481594G-protein coupled receptor 183P32249GPR183Homo sapiens (Human)361

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