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Name | SCHEMBL342766 |
---|---|
Molecular formula | C24H22ClF3N4O3S |
IUPAC name | N-[4-chloro-2-(pyridine-4-carbonyl)phenyl]-4-[4-(2,2,2-trifluoroethyl)piperazin-1-yl]benzenesulfonamide |
Molecular weight | 538.97 |
Hydrogen bond acceptor | 10 |
Hydrogen bond donor | 1 |
XlogP | 4.9 |
Synonyms | IOSUAWDFYFIXQF-UHFFFAOYSA-N N-[4-Chloro-2-(pyridine-4-carbonyl)-phenyl]-4-[4-(2,2,2-trifluoro-ethyl)-piperazin-1-yl]-benzenesulfonamide CHEMBL3719280 |
Inchi Key | IOSUAWDFYFIXQF-UHFFFAOYSA-N |
Inchi ID | InChI=1S/C24H22ClF3N4O3S/c25-18-1-6-22(21(15-18)23(33)17-7-9-29-10-8-17)30-36(34,35)20-4-2-19(3-5-20)32-13-11-31(12-14-32)16-24(26,27)28/h1-10,15,30H,11-14,16H2 |
PubChem CID | 59788719 |
ChEMBL | CHEMBL3719280 |
IUPHAR | N/A |
BindingDB | N/A |
DrugBank | N/A |
Structure | |
Lipinski's druglikeness | This ligand is heavier than 500 daltons. |
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GLASS ID | Name | UniProt | Gene | Species | Length |
---|---|---|---|---|---|
525511 | 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