Molecule ID: mol35701
SMILES: Cc1ccc2[nH]c(C)c(C3(c4c(C)[nH]c5ccc(C)cc45)OC(=O)c4ccccc43)c2c1
InChI: InChI=1S/C28H24N2O2/c1-15-9-11-23-20(13-15)25(17(3)29-23)28(22-8-6-5-7-19(22)27(31)32-28)26-18(4)30-24-12-10-16(2)14-21(24)26/h5-14,29-30H,1-4H3
| Macro pKa value | Dataset | Assigned charge state transition |
|---|---|---|
| 9.70 | QSARToolbox | 0 » -1 |