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Name | CHEMBL440405 |
---|---|
Molecular formula | C20H18FN3O3S |
IUPAC name | 4-[5-cyano-2-(4-fluorophenyl)-1H-indol-3-yl]-N-methylsulfonylbutanamide |
Molecular weight | 399.44 |
Hydrogen bond acceptor | 5 |
Hydrogen bond donor | 2 |
XlogP | 3.0 |
Synonyms | BDBM50236305 4-(5-cyano-2-(4-fluorophenyl)-1H-indol-3-yl)-N-(methylsulfonyl)butanamide |
Inchi Key | OVTPSSRHMPJRCX-UHFFFAOYSA-N |
Inchi ID | InChI=1S/C20H18FN3O3S/c1-28(26,27)24-19(25)4-2-3-16-17-11-13(12-22)5-10-18(17)23-20(16)14-6-8-15(21)9-7-14/h5-11,23H,2-4H2,1H3,(H,24,25) |
PubChem CID | 44447915 |
ChEMBL | CHEMBL440405 |
IUPHAR | N/A |
BindingDB | 50236305 |
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 |
---|---|---|---|---|---|
251489 | C-X-C chemokine receptor type 2 | P25025 | CXCR2 | Homo sapiens (Human) | 360 |
251490 | C-X-C chemokine receptor type 2 | P35344 | CXCR2 | Oryctolagus cuniculus (Rabbit) | 358 |
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