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Name | CHEMBL3800584 |
---|---|
Molecular formula | C23H19ClFN3O4S |
IUPAC name | 4-tert-butyl-N-[7-chloro-2-(4-fluoropyridin-2-yl)-1,3-dioxoisoindol-4-yl]benzenesulfonamide |
Molecular weight | 487.93 |
Hydrogen bond acceptor | 7 |
Hydrogen bond donor | 1 |
XlogP | 5.2 |
Synonyms | SCHEMBL16871354 |
Inchi Key | CJMSBONDJBVSHR-UHFFFAOYSA-N |
Inchi ID | InChI=1S/C23H19ClFN3O4S/c1-23(2,3)13-4-6-15(7-5-13)33(31,32)27-17-9-8-16(24)19-20(17)22(30)28(21(19)29)18-12-14(25)10-11-26-18/h4-12,27H,1-3H3 |
PubChem CID | 118204744 |
ChEMBL | CHEMBL3800584 |
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 |
---|---|---|---|---|---|
522799 | 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