| In ZINC since | Heavy atoms | Benign functionality |
|---|---|---|
| August 15th, 2007 | 31 | 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) | 3.82 | 5.56 | -14.12 | 3 | 7 | 0 | 99 | 441.915 | 7 | ↓ |
| Ref Reference (pH 7) | 3.82 | 5.23 | -11.94 | 3 | 7 | 0 | 99 | 441.915 | 7 | ↓ |
| Hi High (pH 8-9.5) | 3.80 | 5.82 | -44.17 | 1 | 7 | -1 | 98 | 440.907 | 7 | ↓ |
| Hi High (pH 8-9.5) | 3.80 | 5.58 | -51.61 | 1 | 7 | -1 | 98 | 440.907 | 7 | ↓ |
| Hi High (pH 8-9.5) | 3.82 | 6.33 | -39.6 | 2 | 7 | -1 | 102 | 440.907 | 7 | ↓ |
| Mid Mid (pH 6-8) | 3.82 | 5.99 | -49.67 | 2 | 7 | -1 | 102 | 440.907 | 7 | ↓ |
