| In ZINC since | Heavy atoms | Benign functionality |
|---|---|---|
| May 29th, 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) | 3.37 | 12.77 | -20.81 | 1 | 6 | 0 | 68 | 397.413 | 2 | ↓ |
| Mid Mid (pH 6-8) | 3.37 | 12.6 | -41.67 | 0 | 6 | -1 | 66 | 396.405 | 2 | ↓ |
| Lo Low (pH 4.5-6) | 3.37 | 13.05 | -44.86 | 2 | 6 | 1 | 69 | 398.421 | 2 | ↓ |
