| In ZINC since | Heavy atoms | Benign functionality |
|---|---|---|
| September 8th, 2008 | 36 | 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) | 3.16 | 8.14 | -61.05 | 0 | 8 | -1 | 95 | 487.532 | 9 | ↓ |
| Mid Mid (pH 6-8) | 3.61 | 9.38 | -60.43 | 2 | 8 | 1 | 94 | 489.548 | 8 | ↓ |
| Mid Mid (pH 6-8) | 2.58 | 10.42 | -58.81 | 1 | 8 | 1 | 90 | 489.548 | 9 | ↓ |
| Mid Mid (pH 6-8) | 3.16 | 10.49 | -71.92 | 1 | 8 | 0 | 96 | 488.54 | 9 | ↓ |
