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Name | CHEMBL608559 |
---|---|
Molecular formula | C28H17N2O5S- |
IUPAC name | 1-amino-4-(anthracen-2-ylamino)-9,10-dioxoanthracene-2-sulfonate |
Molecular weight | 493.513 |
Hydrogen bond acceptor | 7 |
Hydrogen bond donor | 2 |
XlogP | 6.0 |
Synonyms | GTPL9023 BDBM50307836 Sodium 1-Amino-4-(2-anthracenylamino)-9,10-dioxo-9,10-dihydroanthracene-2-sulfonate 1-amino-4-(anthracen-2-ylamino)-9,10-dioxoanthracene-2-sulfonate |
Inchi Key | JXFRJOYKTCEJDG-UHFFFAOYSA-M |
Inchi ID | InChI=1S/C28H18N2O5S/c29-26-23(36(33,34)35)14-22(24-25(26)28(32)21-8-4-3-7-20(21)27(24)31)30-19-10-9-17-11-15-5-1-2-6-16(15)12-18(17)13-19/h1-14,30H,29H2,(H,33,34,35)/p-1 |
PubChem CID | 91934096 |
ChEMBL | N/A |
IUPHAR | N/A |
BindingDB | 50307836 |
DrugBank | N/A |
Structure | |
Lipinski's druglikeness | This ligand has a partition coefficient log P greater than 5. |
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GLASS ID | Name | UniProt | Gene | Species | Length |
---|---|---|---|---|---|
162298 | P2Y purinoceptor 2 | P41231 | P2RY2 | Homo sapiens (Human) | 377 |
162299 | P2Y purinoceptor 4 | P51582 | P2RY4 | Homo sapiens (Human) | 365 |
162297 | P2Y purinoceptor 6 | Q63371 | P2ry6 | Rattus norvegicus (Rat) | 328 |
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