| In ZINC since | Heavy atoms | Benign functionality |
|---|---|---|
| November 15th, 2008 | 30 | No |
| 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) | 3.85 | 8.97 | -49.56 | 3 | 6 | 1 | 69 | 427.956 | 8 | ↓ |
| Hi High (pH 8-9.5) | 3.85 | 6.72 | -17.7 | 2 | 6 | 0 | 68 | 426.948 | 8 | ↓ |
| Mid Mid (pH 6-8) | 3.85 | 9.07 | -43.89 | 3 | 6 | 1 | 69 | 427.956 | 8 | ↓ |
