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Name | 40951-76-6 |
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Molecular formula | C20H14N3NaO5S |
IUPAC name | sodium;1-amino-4-(4-aminoanilino)-9,10-dioxoanthracene-2-sulfonate |
Molecular weight | 431.398 |
Hydrogen bond acceptor | 8 |
Hydrogen bond donor | 3 |
XlogP | None |
Synonyms | SODIUM 1-AMINO-4-[(4-AMINOPHENYL)AMINO]-9,10-DIHYDRO-9,10-DIOXOANTHRACENE-2-SULFONATE CTK4I4061 1-Amino-2-(sodiooxysulfonyl)-4-(4-aminophenylamino)-9,10-anthraquinone SCHEMBL3029895 2-Anthracenesulfonicacid, 1-amino-4-[(4-aminophenyl)amino]-9,10-dihydro-9,10-dioxo-, sodium salt(1:1) [ Show all ] |
Inchi Key | BRJFZCXWKYXAOE-UHFFFAOYSA-M |
Inchi ID | InChI=1S/C20H15N3O5S.Na/c21-10-5-7-11(8-6-10)23-14-9-15(29(26,27)28)18(22)17-16(14)19(24)12-3-1-2-4-13(12)20(17)25;/h1-9,23H,21-22H2,(H,26,27,28);/q;+1/p-1 |
PubChem CID | 23662764 |
ChEMBL | CHEMBL496012 |
IUPHAR | N/A |
BindingDB | N/A |
DrugBank | N/A |
Structure | |
Lipinski's druglikeness | Partition coefficient log P of this ligand is not available. |
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GLASS ID | Name | UniProt | Gene | Species | Length |
---|---|---|---|---|---|
31033 | P2Y purinoceptor 12 | Q9H244 | P2RY12 | Homo sapiens (Human) | 342 |
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