| In ZINC since | Heavy atoms | Benign functionality |
|---|---|---|
| November 12th, 2008 | 18 | Yes |
Popular Name: 3-[(2S)-2-hydroxy-3-methylamino-propyl]-2H-phthalazine-1,4-dione 3-[(2S)-2-hydroxy-3-methylamino-…
| Type pH range | xlogP | Des A‑Pol Apolar desolvation (kcal/mol) | Des Pol Polar desolvation (kcal/mol) | H Don H-bond donors | H Acc H-bond acceptors | Chg Net charge | tPSA (Ų) | MWT Molecular weight (g/mol) | RB Rotatable bonds | DL |
|---|---|---|---|---|---|---|---|---|---|---|
| Ref Reference (pH 7) | 0.29 | -0.53 | -48.29 | 3 | 6 | 0 | 95 | 249.27 | 4 | ↓ |
| Hi High (pH 8-9.5) | 0.29 | -2.02 | -39.39 | 2 | 6 | -1 | 90 | 248.262 | 4 | ↓ |
| Lo Low (pH 4.5-6) | 0.29 | -1.63 | -41.46 | 4 | 6 | 1 | 92 | 250.278 | 4 | ↓ |
