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Name | CHEMBL256864 |
---|---|
Molecular formula | C21H15N2O5S- |
IUPAC name | 1-amino-4-(2-methylanilino)-9,10-dioxoanthracene-2-sulfonate |
Molecular weight | 407.42 |
Hydrogen bond acceptor | 7 |
Hydrogen bond donor | 2 |
XlogP | 3.9 |
Synonyms | sodium 1-amino-9,10-dioxo-4-(o-tolylamino)-9,10-dihydroanthracene-2-sulfonate BDBM50336786 sodium 4-(o-toluidino)-1-amino-9,10-dioxo-9,10-dihydroanthracene-2-sulfonate |
Inchi Key | IDRCEVKPWMZGEN-UHFFFAOYSA-M |
Inchi ID | InChI=1S/C21H16N2O5S/c1-11-6-2-5-9-14(11)23-15-10-16(29(26,27)28)19(22)18-17(15)20(24)12-7-3-4-8-13(12)21(18)25/h2-10,23H,22H2,1H3,(H,26,27,28)/p-1 |
PubChem CID | 91932497 |
ChEMBL | N/A |
IUPHAR | N/A |
BindingDB | 50336786 |
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 |
---|---|---|---|---|---|
130742 | P2Y purinoceptor 2 | P35383 | P2ry2 | Mus musculus (Mouse) | 373 |
130743 | P2Y purinoceptor 2 | P41231 | P2RY2 | Homo sapiens (Human) | 377 |
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