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Name | CHEMBL303743 |
---|---|
Molecular formula | C21H22ClN3O6S2 |
IUPAC name | [3-[[3-[(4-chloro-3-methyl-1,2-oxazol-5-yl)sulfamoyl]thiophene-2-carbonyl]amino]-2,4,6-trimethylphenyl]methyl acetate |
Molecular weight | 511.992 |
Hydrogen bond acceptor | 9 |
Hydrogen bond donor | 2 |
XlogP | 3.9 |
Synonyms | N-(4-chloro-3-methyl-5-isoxazolyl)-2-(3-acetoxymethyl-2,4,6-trimethylphenylaminocarbonyl)thiophene-3-sulfonamide 2-[[[3-(Acetoxymethyl)-2,4,6-trimethylphenyl]amino]carbonyl]-N-(4-chloro-3-methylisoxazole-5-yl)-3-thiophenesulfonamide SCHEMBL4631362 AJDYXXCWHDGBML-UHFFFAOYSA-N N-(4-chloro-3-methyl-5-isoxazolyl)-2-(3-acetoxymethyl-2,4, 6-trimethylphenylaminocarbonyl)thiophene-3-sulfonamide |
Inchi Key | AJDYXXCWHDGBML-UHFFFAOYSA-N |
Inchi ID | InChI=1S/C21H22ClN3O6S2/c1-10-8-11(2)18(12(3)15(10)9-30-14(5)26)23-20(27)19-16(6-7-32-19)33(28,29)25-21-17(22)13(4)24-31-21/h6-8,25H,9H2,1-5H3,(H,23,27) |
PubChem CID | 10791859 |
ChEMBL | CHEMBL303743 |
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 |
---|---|---|---|---|---|
6824 | Endothelin-1 receptor | P25101 | EDNRA | Homo sapiens (Human) | 427 |
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