| In ZINC since | Heavy atoms | Benign functionality |
|---|---|---|
| July 18th, 2008 | 25 | 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) | 6.12 | 7.81 | -8.14 | 2 | 5 | 0 | 78 | 481.702 | 1 | ↓ |
| Ref Reference (pH 7) | 6.12 | 7.39 | -8.86 | 2 | 5 | 0 | 78 | 481.702 | 1 | ↓ |
| Mid Mid (pH 6-8) | 7.04 | 3.61 | -103.67 | 0 | 5 | -2 | 84 | 479.686 | 1 | ↓ |
| Mid Mid (pH 6-8) | 6.58 | 5.58 | -43.79 | 1 | 5 | -1 | 81 | 480.694 | 1 | ↓ |
| Mid Mid (pH 6-8) | 6.58 | 5.44 | -41.19 | 1 | 5 | -1 | 81 | 480.694 | 1 | ↓ |
| Mid Mid (pH 6-8) | 7.04 | 4.29 | -100.63 | 0 | 5 | -2 | 84 | 479.686 | 1 | ↓ |
| Mid Mid (pH 6-8) | 6.58 | 6.26 | -42.46 | 1 | 5 | -1 | 81 | 480.694 | 1 | ↓ |
| Mid Mid (pH 6-8) | 6.58 | 5.85 | -38.62 | 1 | 5 | -1 | 81 | 480.694 | 1 | ↓ |
