| In ZINC since | Heavy atoms | Benign functionality |
|---|---|---|
| January 28th, 2006 | 27 | Yes |
Popular Name: 4-[4-(2,3-dimethylphenyl)piperazin-1-yl]carbonyl-2H-phthalazin-1-one 4-[4-(2,3-dimethylphenyl)piperaz…
| 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) | 3.25 | 8.88 | -8.1 | 1 | 6 | 0 | 69 | 362.433 | 2 | ↓ |
| Hi High (pH 8-9.5) | 3.71 | 7.08 | -44.58 | 0 | 6 | -1 | 72 | 361.425 | 2 | ↓ |
| Mid Mid (pH 6-8) | 3.25 | 8.8 | -40.83 | 2 | 6 | 1 | 70 | 363.441 | 2 | ↓ |
