Molecule ID: mol19371
SMILES: NC(=O)CCCCCCCc1ccc(Nc2c3ccccc3nc3ccccc23)cc1
InChI: InChI=1S/C27H29N3O/c28-26(31)15-5-3-1-2-4-10-20-16-18-21(19-17-20)29-27-22-11-6-8-13-24(22)30-25-14-9-7-12-23(25)27/h6-9,11-14,16-19H,1-5,10,15H2,(H2,28,31)(H,29,30)
| Macro pKa value | Dataset | Assigned charge state transition |
|---|---|---|
| 7.70 | Baltruschat ChEMBL | 1 » 0 |