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Name | CHEMBL257829 |
---|---|
Molecular formula | C20H19FN4O3S |
IUPAC name | 4-[5-cyano-2-(4-fluorophenyl)-1H-indol-3-yl]-N-(methylsulfamoyl)butanamide |
Molecular weight | 414.455 |
Hydrogen bond acceptor | 6 |
Hydrogen bond donor | 3 |
XlogP | 2.7 |
Synonyms | BDBM50236295 4-[5-cyano-2-(4-fluorophenyl)-1H-indol-3-yl]-N-[(methylamino)sulfonyl]butanamide |
Inchi Key | OEKBSTHRROXMTR-UHFFFAOYSA-N |
Inchi ID | InChI=1S/C20H19FN4O3S/c1-23-29(27,28)25-19(26)4-2-3-16-17-11-13(12-22)5-10-18(17)24-20(16)14-6-8-15(21)9-7-14/h5-11,23-24H,2-4H2,1H3,(H,25,26) |
PubChem CID | 44447928 |
ChEMBL | CHEMBL257829 |
IUPHAR | N/A |
BindingDB | 50236295 |
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 |
---|---|---|---|---|---|
239202 | C-X-C chemokine receptor type 2 | P25025 | CXCR2 | Homo sapiens (Human) | 360 |
239203 | C-X-C chemokine receptor type 2 | P35344 | CXCR2 | Oryctolagus cuniculus (Rabbit) | 358 |
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