Molecule ID: mol16051
SMILES: NP(=O)(O)N(CCCl)CCCl
InChI: InChI=1S/C4H11Cl2N2O2P/c5-1-3-8(4-2-6)11(7,9)10/h1-4H2,(H3,7,9,10)
| Macro pKa value | Dataset | Assigned charge state transition |
|---|---|---|
| 4.58 | Baltruschat ChEMBL | 0 » -1 |
| 4.75 | Baltruschat ChEMBL | 0 » -1 |
| 4.75 | Baltruschat ChEMBL | 0 » -1 |
| 4.75 | Baltruschat ChEMBL | 0 » -1 |
| 4.75 | QSARToolbox | 0 » -1 |
| 4.80 | Baltruschat ChEMBL | 0 » -1 |
| 4.90 | OCHEM | 0 » -1 |