Molecule ID: mol17297
SMILES: C[C@H](CO)Nc1nc(SCc2cccc(F)c2F)nc2[nH]c(=O)c(=O)[nH]c12
InChI: InChI=1S/C16H15F2N5O3S/c1-7(5-24)19-12-11-13(21-15(26)14(25)20-11)23-16(22-12)27-6-8-3-2-4-9(17)10(8)18/h2-4,7,24H,5-6H2,1H3,(H,20,25)(H2,19,21,22,23,26)/t7-/m1/s1
| Macro pKa value | Dataset | Assigned charge state transition |
|---|---|---|
| 6.50 | Baltruschat ChEMBL | 0 » -1 |