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Ligand

NameCHEMBL3717500
Molecular formulaC22H20ClN3O4S
IUPAC nameN-[4-chloro-2-(pyridine-3-carbonyl)phenyl]-4-morpholin-4-ylbenzenesulfonamide
Molecular weight457.929
Hydrogen bond acceptor7
Hydrogen bond donor1
XlogP3.6
SynonymsSCHEMBL10252783
Inchi KeyFXKGQIIPJLWRON-UHFFFAOYSA-N
Inchi IDInChI=1S/C22H20ClN3O4S/c23-17-3-8-21(20(14-17)22(27)16-2-1-9-24-15-16)25-31(28,29)19-6-4-18(5-7-19)26-10-12-30-13-11-26/h1-9,14-15,25H,10-13H2
PubChem CID59788545
ChEMBLCHEMBL3717500
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
524116C-C chemokine receptor type 9P51686CCR9Homo sapiens (Human)369

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