| In ZINC since | Heavy atoms | Benign functionality |
|---|---|---|
| January 11th, 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) | 3.64 | 9.81 | -52.42 | 0 | 5 | -1 | 70 | 400.882 | 5 | ↓ |
| Mid Mid (pH 6-8) | 4.08 | -1.81 | -30.74 | 1 | 5 | 0 | 66 | 401.89 | 4 | ↓ |
| Mid Mid (pH 6-8) | 3.05 | -1.48 | -22.1 | 0 | 5 | 0 | 63 | 401.89 | 5 | ↓ |
