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Name | SCHEMBL344097 |
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Molecular formula | C24H23ClN2O4S |
IUPAC name | N-[4-chloro-2-(pyridine-3-carbonyl)phenyl]-4-(4-methyloxan-4-yl)benzenesulfonamide |
Molecular weight | 470.968 |
Hydrogen bond acceptor | 6 |
Hydrogen bond donor | 1 |
XlogP | 4.8 |
Synonyms | IURAIAJMBHUDBN-UHFFFAOYSA-N N-[4-Chloro-2-(pyridine-3-carbonyl)-phenyl]-4-(4-methyl-tetrahydro-pyran-4-yl)-benzenesulfonamide CHEMBL3714829 |
Inchi Key | IURAIAJMBHUDBN-UHFFFAOYSA-N |
Inchi ID | InChI=1S/C24H23ClN2O4S/c1-24(10-13-31-14-11-24)18-4-7-20(8-5-18)32(29,30)27-22-9-6-19(25)15-21(22)23(28)17-3-2-12-26-16-17/h2-9,12,15-16,27H,10-11,13-14H2,1H3 |
PubChem CID | 11155651 |
ChEMBL | CHEMBL3714829 |
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 |
---|---|---|---|---|---|
525637 | 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