| In ZINC since | Heavy atoms | Benign functionality |
|---|---|---|
| July 13th, 2009 | 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) | 3.75 | 8.71 | -12.99 | 3 | 6 | 0 | 99 | 422.554 | 7 | ↓ |
| Hi High (pH 8-9.5) | 3.94 | 7.42 | -46.07 | 2 | 6 | -1 | 106 | 421.546 | 7 | ↓ |
| Mid Mid (pH 6-8) | 3.75 | 8.83 | -37.72 | 4 | 6 | 0 | 100 | 423.562 | 7 | ↓ |
