| In ZINC since | Heavy atoms | Benign functionality |
|---|---|---|
| August 4th, 2007 | 33 | 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) | 4.64 | 12.77 | -81.61 | 1 | 6 | 0 | 74 | 515.448 | 9 | ↓ |
| Mid Mid (pH 6-8) | 5.08 | 12.72 | -44.43 | 2 | 6 | 1 | 71 | 516.456 | 8 | ↓ |
| Mid Mid (pH 6-8) | 4.05 | 12.7 | -48.34 | 1 | 6 | 1 | 68 | 516.456 | 9 | ↓ |
