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Name | CHEMBL401735 |
---|---|
Molecular formula | C21H15N2O6S- |
IUPAC name | 1-amino-4-(4-methoxyanilino)-9,10-dioxoanthracene-2-sulfonate |
Molecular weight | 423.419 |
Hydrogen bond acceptor | 8 |
Hydrogen bond donor | 2 |
XlogP | 3.5 |
Synonyms | SB-416 1-amino-4-(4-methoxyphenyl)-2-sulfoanthraquinone BDBM50227023 sodium 1-amino-4-(4-methoxyphenylamino)-9,10-dioxo-9,10-dihydroanthracene-2-sulfonate 1-Amino-4-(4-methoxyphenylamino)-2-sulfonatoanthracene-9,10-dione |
Inchi Key | MURCBJRRFKMCAT-UHFFFAOYSA-M |
Inchi ID | InChI=1S/C21H16N2O6S/c1-29-12-8-6-11(7-9-12)23-15-10-16(30(26,27)28)19(22)18-17(15)20(24)13-4-2-3-5-14(13)21(18)25/h2-10,23H,22H2,1H3,(H,26,27,28)/p-1 |
PubChem CID | 59448176 |
ChEMBL | N/A |
IUPHAR | N/A |
BindingDB | 50227023 |
DrugBank | N/A |
Structure | ![]() |
Lipinski's druglikeness | This ligand satisfies Lipinski's rule of five. |
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GLASS ID | Name | UniProt | Gene | Species | Length |
---|---|---|---|---|---|
214609 | P2Y purinoceptor 2 | P35383 | P2ry2 | Mus musculus (Mouse) | 373 |
214610 | P2Y purinoceptor 2 | P41231 | P2RY2 | Homo sapiens (Human) | 377 |
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