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Name | SCHEMBL343149 |
---|---|
Molecular formula | C22H21ClN2O5S |
IUPAC name | N-[4-chloro-2-(2-methyl-1-oxidopyridin-1-ium-4-carbonyl)phenyl]-4-propan-2-yloxybenzenesulfonamide |
Molecular weight | 460.929 |
Hydrogen bond acceptor | 6 |
Hydrogen bond donor | 1 |
XlogP | 4.1 |
Synonyms | CHEMBL3717793 |
Inchi Key | DWCDKSMXGFXHSL-UHFFFAOYSA-N |
Inchi ID | InChI=1S/C22H21ClN2O5S/c1-14(2)30-18-5-7-19(8-6-18)31(28,29)24-21-9-4-17(23)13-20(21)22(26)16-10-11-25(27)15(3)12-16/h4-14,24H,1-3H3 |
PubChem CID | 10322032 |
ChEMBL | CHEMBL3717793 |
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 |
---|---|---|---|---|---|
523598 | 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