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Name | SCHEMBL344456 |
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Molecular formula | C23H23ClN2O4S |
IUPAC name | 4-tert-butyl-N-[4-chloro-2-(2-methyl-1-oxidopyridin-1-ium-3-carbonyl)phenyl]benzenesulfonamide |
Molecular weight | 458.957 |
Hydrogen bond acceptor | 5 |
Hydrogen bond donor | 1 |
XlogP | 5.0 |
Synonyms | CHEMBL3718414 |
Inchi Key | FAUONTNUWIUZHU-UHFFFAOYSA-N |
Inchi ID | InChI=1S/C23H23ClN2O4S/c1-15-19(6-5-13-26(15)28)22(27)20-14-17(24)9-12-21(20)25-31(29,30)18-10-7-16(8-11-18)23(2,3)4/h5-14,25H,1-4H3 |
PubChem CID | 22327300 |
ChEMBL | CHEMBL3718414 |
IUPHAR | N/A |
BindingDB | N/A |
DrugBank | N/A |
Structure | |
Lipinski's druglikeness | This ligand satisfies Lipinski's rule of five. |
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GLASS ID | Name | UniProt | Gene | Species | Length |
---|---|---|---|---|---|
523711 | C-C chemokine receptor type 9 | P51686 | CCR9 | Homo sapiens (Human) | 369 |
zhanglabzhanggroup.org | (734) 647-1549 | 100 Washtenaw Avenue, Ann Arbor, MI 48109-2218