| In ZINC since | Heavy atoms | Benign functionality |
|---|---|---|
| August 15th, 2007 | 31 | 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) | 3.07 | 6.91 | -54.65 | 0 | 7 | -1 | 86 | 464.325 | 7 | ↓ |
| Mid Mid (pH 6-8) | 3.51 | 0.29 | -51.73 | 2 | 7 | 1 | 84 | 466.341 | 6 | ↓ |
| Mid Mid (pH 6-8) | 2.48 | -0.02 | -53.43 | 1 | 7 | 1 | 81 | 466.341 | 7 | ↓ |
| Mid Mid (pH 6-8) | 3.07 | 9.25 | -72.34 | 1 | 7 | 0 | 87 | 465.333 | 7 | ↓ |
