Molecule ID: mol20370
SMILES: Cc1cc(COc2ccc(C(=O)NC3(CC(=O)NO)CCN(CCF)CC3)cc2)c2ccccc2n1
InChI: InChI=1S/C27H31FN4O4/c1-19-16-21(23-4-2-3-5-24(23)29-19)18-36-22-8-6-20(7-9-22)26(34)30-27(17-25(33)31-35)10-13-32(14-11-27)15-12-28/h2-9,16,35H,10-15,17-18H2,1H3,(H,30,34)(H,31,33)
| Macro pKa value | Dataset | Assigned charge state transition |
|---|---|---|
| 7.20 | Baltruschat ChEMBL | 1 » 0 |