| In ZINC since | Heavy atoms | Benign functionality |
|---|---|---|
| January 5th, 2009 | 29 | Yes |
Popular Name: 4-[4-[(4-isopropylphenyl)methyl]piperazine-1-carbonyl]-2H-phthalazin-1-one 4-[4-[(4-isopropylphenyl)methyl]…
| 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) | 3.66 | 7.92 | -8.38 | 1 | 6 | 0 | 69 | 390.487 | 4 | ↓ |
| Hi High (pH 8-9.5) | 4.12 | 6.15 | -44.24 | 0 | 6 | -1 | 72 | 389.479 | 4 | ↓ |
| Mid Mid (pH 6-8) | 3.66 | 10.13 | -47.7 | 2 | 6 | 1 | 70 | 391.495 | 4 | ↓ |
