| In ZINC since | Heavy atoms | Benign functionality |
|---|---|---|
| October 29th, 2011 | 25 | Yes |
Popular Name: N-(3-hydroxy-2-pyridyl)-3-isobutyl-4-oxo-phthalazine-1-carboxamide N-(3-hydroxy-2-pyridyl)-3-isobut…
| 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) | 2.33 | 6.14 | -44.35 | 1 | 7 | -1 | 100 | 337.359 | 4 | ↓ |
| Mid Mid (pH 6-8) | 2.33 | 5.38 | -12.86 | 2 | 7 | 0 | 97 | 338.367 | 4 | ↓ |
| Mid Mid (pH 6-8) | 2.33 | 6.18 | -21.56 | 2 | 7 | 0 | 101 | 338.367 | 4 | ↓ |
No pre-computed analogs available. Try a structural similarity search.
