| In ZINC since | Heavy atoms | Benign functionality |
|---|---|---|
| August 3rd, 2008 | 33 | Yes |
| 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) | 1.92 | 1.39 | -38.83 | 1 | 9 | -1 | 120 | 486.448 | 9 | ↓ |
| Hi High (pH 8-9.5) | 1.92 | 1.18 | -120.11 | 0 | 9 | -2 | 122 | 485.44 | 9 | ↓ |
| Mid Mid (pH 6-8) | 2.29 | 3.81 | -13.89 | 2 | 9 | 0 | 114 | 487.456 | 9 | ↓ |
| Mid Mid (pH 6-8) | 2.29 | 3.65 | -41.08 | 1 | 9 | -1 | 116 | 486.448 | 9 | ↓ |
| Mid Mid (pH 6-8) | 1.92 | 0.63 | -18.35 | 2 | 9 | 0 | 118 | 487.456 | 9 | ↓ |
