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Name | CHEMBL172071 |
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Molecular formula | C26H33N5O7S2 |
IUPAC name | N-[2-cyclopropyl-6-[2-(ethylsulfonylamino)ethoxy]-5-(2-methoxyphenoxy)pyrimidin-4-yl]-5-propan-2-ylpyridine-2-sulfonamide |
Molecular weight | 591.698 |
Hydrogen bond acceptor | 12 |
Hydrogen bond donor | 2 |
XlogP | 3.3 |
Synonyms | N-[2-[2-Cyclopropyl-5-(2-methoxyphenoxy)6-(5-isopropyl-2-pyridinylsulfonylamino)-4-pyrimidinyloxy]ethyl]ethanesulfonamide 5-i-propyl-N-[6-(2-ethanesulfonylamino-ethoxy)-5-(o-methoxyphenoxy)-2-cyclopropyl-pyrimidin-4-yl]-pyridine-2-sulfonamide SCHEMBL7196209 BDBM50124428 GWBCKOWLDKFIHO-UHFFFAOYSA-N [ Show all ] |
Inchi Key | GWBCKOWLDKFIHO-UHFFFAOYSA-N |
Inchi ID | InChI=1S/C26H33N5O7S2/c1-5-39(32,33)28-14-15-37-26-23(38-21-9-7-6-8-20(21)36-4)25(29-24(30-26)18-10-11-18)31-40(34,35)22-13-12-19(16-27-22)17(2)3/h6-9,12-13,16-18,28H,5,10-11,14-15H2,1-4H3,(H,29,30,31) |
PubChem CID | 9873255 |
ChEMBL | CHEMBL172071 |
IUPHAR | N/A |
BindingDB | 50124428 |
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 |
---|---|---|---|---|---|
106736 | Endothelin receptor type B | P21451 | Ednrb | Rattus norvegicus (Rat) | 442 |
106738 | Endothelin receptor type B | P24530 | EDNRB | Homo sapiens (Human) | 442 |
106737 | Endothelin-1 receptor | P25101 | EDNRA | Homo sapiens (Human) | 427 |
106739 | Endothelin-1 receptor | P26684 | Ednra | Rattus norvegicus (Rat) | 426 |
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