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Ligand

NameCHEMBL3797989
Molecular formulaC25H24ClN3O5S
IUPAC name4-tert-butyl-N-[7-chloro-2-(6-methoxy-2-methylpyridin-3-yl)-1,3-dioxoisoindol-4-yl]benzenesulfonamide
Molecular weight513.993
Hydrogen bond acceptor7
Hydrogen bond donor1
XlogP5.5
SynonymsSCHEMBL16871154
Inchi KeyHJFREMUHBHKZEU-UHFFFAOYSA-N
Inchi IDInChI=1S/C25H24ClN3O5S/c1-14-19(12-13-20(27-14)34-5)29-23(30)21-17(26)10-11-18(22(21)24(29)31)28-35(32,33)16-8-6-15(7-9-16)25(2,3)4/h6-13,28H,1-5H3
PubChem CID118204557
ChEMBLCHEMBL3797989
IUPHARN/A
BindingDBN/A
DrugBankN/A

Structure

SDF download

2D structure
Lipinski's druglikenessThis ligand is heavier than 500 daltons.
This ligand has a partition coefficient log P greater than 5.

Known GPCRs

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Total entries: 1
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GLASS IDNameUniProtGeneSpeciesLength
524888C-C chemokine receptor type 9P51686CCR9Homo sapiens (Human)369

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