| In ZINC since | Heavy atoms | Benign functionality |
|---|---|---|
| April 7th, 2009 | 24 | Yes |
Popular Name: N-[(2S)-2-(diethylamino)-3-methyl-butyl]-4-oxo-3H-phthalazine-1-carboxamide N-[(2S)-2-(diethylamino)-3-methy…
| 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) | 2.51 | 6.31 | -43.23 | 3 | 6 | 1 | 79 | 331.44 | 7 | ↓ |
| Hi High (pH 8-9.5) | 2.96 | 3.45 | -39.9 | 1 | 6 | -1 | 81 | 329.424 | 7 | ↓ |
| Mid Mid (pH 6-8) | 2.96 | 5.5 | -51.3 | 2 | 6 | 0 | 82 | 330.432 | 7 | ↓ |
