| In ZINC since | Heavy atoms | Benign functionality |
|---|---|---|
| November 27th, 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) | 3.27 | 8.61 | -52.68 | 1 | 6 | 1 | 56 | 427.546 | 5 | ↓ |
| Hi High (pH 8-9.5) | 3.27 | 5.7 | -9.87 | 0 | 6 | 0 | 55 | 426.538 | 5 | ↓ |
| Mid Mid (pH 6-8) | 3.27 | 7.89 | -46.64 | 1 | 6 | 1 | 56 | 427.546 | 5 | ↓ |
| Lo Low (pH 4.5-6) | 3.27 | 10.74 | -125.26 | 2 | 6 | 2 | 58 | 428.554 | 5 | ↓ |
