| In ZINC since | Heavy atoms | Benign functionality |
|---|---|---|
| August 15th, 2007 | 30 | 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) | 4.70 | 6.51 | -13.49 | 3 | 6 | 0 | 89 | 466.752 | 5 | ↓ |
| Ref Reference (pH 7) | 4.70 | 5.86 | -12.11 | 3 | 6 | 0 | 89 | 466.752 | 5 | ↓ |
| Hi High (pH 8-9.5) | 4.67 | 6.64 | -40.14 | 1 | 6 | -1 | 88 | 465.744 | 5 | ↓ |
| Hi High (pH 8-9.5) | 4.67 | 6.18 | -48.49 | 1 | 6 | -1 | 88 | 465.744 | 5 | ↓ |
| Hi High (pH 8-9.5) | 4.70 | 6.69 | -35.28 | 2 | 6 | -1 | 92 | 465.744 | 5 | ↓ |
| Mid Mid (pH 6-8) | 4.70 | 6.62 | -47.59 | 2 | 6 | -1 | 92 | 465.744 | 5 | ↓ |
