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Name | SCHEMBL343613 |
---|---|
Molecular formula | C20H17ClN2O5S2 |
IUPAC name | N-[4-chloro-2-(2-methylpyridine-4-carbonyl)phenyl]-4-methylsulfonylbenzenesulfonamide |
Molecular weight | 464.935 |
Hydrogen bond acceptor | 7 |
Hydrogen bond donor | 1 |
XlogP | 3.5 |
Synonyms | HTNDACHVFIJNRL-UHFFFAOYSA-N N-[4-Chloro-2-(2-methyl-pyridine-4-carbonyl)-phenyl]-4-methanesulfonyl-benzenesulfonamide CHEMBL3714927 |
Inchi Key | HTNDACHVFIJNRL-UHFFFAOYSA-N |
Inchi ID | InChI=1S/C20H17ClN2O5S2/c1-13-11-14(9-10-22-13)20(24)18-12-15(21)3-8-19(18)23-30(27,28)17-6-4-16(5-7-17)29(2,25)26/h3-12,23H,1-2H3 |
PubChem CID | 10253911 |
ChEMBL | CHEMBL3714927 |
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 |
---|---|---|---|---|---|
525119 | 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