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Name | CHEMBL420501 |
---|---|
Molecular formula | C26H28N6O4S2 |
IUPAC name | 4-tert-butyl-N-[6-[2-(5-methylsulfanylpyrimidin-2-yl)oxyethoxy]-5-pyridin-4-ylpyrimidin-4-yl]benzenesulfonamide |
Molecular weight | 552.668 |
Hydrogen bond acceptor | 11 |
Hydrogen bond donor | 1 |
XlogP | 4.4 |
Synonyms | BDBM50105016 SCHEMBL7481169 4-tert-Butyl-N-{6-[2-(5-methylsulfanyl-pyrimidin-2-yloxy)-ethoxy]-5-pyridin-4-yl-pyrimidin-4-yl}-benzenesulfonamide |
Inchi Key | GACZLMXVTORVRP-UHFFFAOYSA-N |
Inchi ID | InChI=1S/C26H28N6O4S2/c1-26(2,3)19-5-7-21(8-6-19)38(33,34)32-23-22(18-9-11-27-12-10-18)24(31-17-30-23)35-13-14-36-25-28-15-20(37-4)16-29-25/h5-12,15-17H,13-14H2,1-4H3,(H,30,31,32) |
PubChem CID | 11734340 |
ChEMBL | CHEMBL420501 |
IUPHAR | N/A |
BindingDB | 50105016 |
DrugBank | N/A |
Structure | |
Lipinski's druglikeness | This ligand has more than 10 hydrogen bond acceptor. This ligand is heavier than 500 daltons. |
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GLASS ID | Name | UniProt | Gene | Species | Length |
---|---|---|---|---|---|
91515 | Endothelin-1 receptor | Q29010 | EDNRA | Sus scrofa (Pig) | 427 |
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