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Name | CHEMBL3797603 |
---|---|
Molecular formula | C24H21ClFN3O4S |
IUPAC name | 4-tert-butyl-N-[7-chloro-2-[(3-fluoropyridin-2-yl)methyl]-1,3-dioxoisoindol-4-yl]benzenesulfonamide |
Molecular weight | 501.957 |
Hydrogen bond acceptor | 7 |
Hydrogen bond donor | 1 |
XlogP | 4.8 |
Synonyms | SCHEMBL16871152 |
Inchi Key | CGUSHNGXBLNVHT-UHFFFAOYSA-N |
Inchi ID | InChI=1S/C24H21ClFN3O4S/c1-24(2,3)14-6-8-15(9-7-14)34(32,33)28-18-11-10-16(25)20-21(18)23(31)29(22(20)30)13-19-17(26)5-4-12-27-19/h4-12,28H,13H2,1-3H3 |
PubChem CID | 118204555 |
ChEMBL | CHEMBL3797603 |
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 |
---|---|---|---|---|---|
522765 | C-C chemokine receptor type 9 | P51686 | CCR9 | Homo sapiens (Human) | 369 |
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