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Ligand

NameCHEMBL3800291
Molecular formulaC25H24ClN3O5S
IUPAC name4-tert-butyl-N-[7-chloro-2-[(5-methyl-1-oxidopyridin-1-ium-2-yl)methyl]-1,3-dioxoisoindol-4-yl]benzenesulfonamide
Molecular weight513.993
Hydrogen bond acceptor6
Hydrogen bond donor1
XlogP4.1
SynonymsSCHEMBL18353638
Inchi KeyASPFFBZLAUUDQN-UHFFFAOYSA-N
Inchi IDInChI=1S/C25H24ClN3O5S/c1-15-5-8-17(29(32)13-15)14-28-23(30)21-19(26)11-12-20(22(21)24(28)31)27-35(33,34)18-9-6-16(7-10-18)25(2,3)4/h5-13,27H,14H2,1-4H3
PubChem CID123866952
ChEMBLCHEMBL3800291
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
Page:  / 1 

GLASS IDNameUniProtGeneSpeciesLength
521848C-C chemokine receptor type 9P51686CCR9Homo sapiens (Human)369

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