| In ZINC since | Heavy atoms | Benign functionality |
|---|---|---|
| November 21st, 2009 | 20 | 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) | 2.53 | 4.76 | -49.5 | 2 | 4 | 1 | 38 | 295.79 | 3 | ↓ |
| Hi High (pH 8-9.5) | 2.53 | 3.81 | -5.1 | 1 | 4 | 0 | 34 | 294.782 | 3 | ↓ |
| Lo Low (pH 4.5-6) | 2.53 | 6.31 | -38.04 | 2 | 4 | 1 | 35 | 295.79 | 3 | ↓ |
| Lo Low (pH 4.5-6) | 2.53 | 7.24 | -119.92 | 3 | 4 | 2 | 40 | 296.798 | 3 | ↓ |
