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Name | SCHEMBL343808 |
---|---|
Molecular formula | C25H25ClN2O4S |
IUPAC name | N-[4-chloro-2-(6-methylpyridine-2-carbonyl)phenyl]-4-(4-methyloxan-4-yl)benzenesulfonamide |
Molecular weight | 484.995 |
Hydrogen bond acceptor | 6 |
Hydrogen bond donor | 1 |
XlogP | 5.6 |
Synonyms | N-[4-Chloro-2-(6-methyl-pyridine-2-carbonyl)-phenyl]-4-(4-methyl-tetrahydro-pyran-4-yl)-benzenesulfonamide CHEMBL3718996 DEJQEPBWGLUZJS-UHFFFAOYSA-N |
Inchi Key | DEJQEPBWGLUZJS-UHFFFAOYSA-N |
Inchi ID | InChI=1S/C25H25ClN2O4S/c1-17-4-3-5-23(27-17)24(29)21-16-19(26)8-11-22(21)28-33(30,31)20-9-6-18(7-10-20)25(2)12-14-32-15-13-25/h3-11,16,28H,12-15H2,1-2H3 |
PubChem CID | 59788697 |
ChEMBL | CHEMBL3718996 |
IUPHAR | N/A |
BindingDB | N/A |
DrugBank | N/A |
Structure | |
Lipinski's druglikeness | This ligand has a partition coefficient log P greater than 5. |
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GLASS ID | Name | UniProt | Gene | Species | Length |
---|---|---|---|---|---|
523240 | 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