| In ZINC since | Heavy atoms | Benign functionality |
|---|---|---|
| May 21st, 2011 | 21 | Yes |
Popular Name: 4-[(3S)-3-(dimethylamino)pyrrolidine-1-carbonyl]-2H-phthalazin-1-one 4-[(3S)-3-(dimethylamino)pyrroli…
| 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) | 1.01 | 5.1 | -45.57 | 2 | 6 | 1 | 70 | 287.343 | 2 | ↓ |
| Hi High (pH 8-9.5) | 1.47 | 0.89 | -45.4 | 0 | 6 | -1 | 72 | 285.327 | 2 | ↓ |
| Mid Mid (pH 6-8) | 1.47 | 3.31 | -67.98 | 1 | 6 | 0 | 74 | 286.335 | 2 | ↓ |
No pre-computed analogs available. Try a structural similarity search.
