| In ZINC since | Heavy atoms | Benign functionality |
|---|---|---|
| April 10th, 2006 | 28 | 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) | 3.92 | 9.32 | -59.98 | 0 | 5 | -1 | 74 | 396.85 | 5 | ↓ |
| Mid Mid (pH 6-8) | 3.92 | 0.98 | -10.44 | 1 | 5 | 0 | 70 | 397.858 | 5 | ↓ |
| Mid Mid (pH 6-8) | 3.33 | 0.74 | -12.09 | 0 | 5 | 0 | 67 | 397.858 | 5 | ↓ |
