| In ZINC since | Heavy atoms | Benign functionality |
|---|---|---|
| May 21st, 2010 | 21 | 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) | 2.79 | 7.1 | -38.81 | 2 | 4 | 1 | 38 | 295.447 | 9 | ↓ |
| Hi High (pH 8-9.5) | 2.79 | 3.13 | -3.74 | 1 | 4 | 0 | 34 | 294.439 | 9 | ↓ |
| Mid Mid (pH 6-8) | 2.79 | 4.89 | -31.38 | 2 | 4 | 1 | 35 | 295.447 | 9 | ↓ |
