| In ZINC since | Heavy atoms | Benign functionality |
|---|---|---|
| July 21st, 2010 | 12 | No |
| 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) | 1.58 | 2.5 | -32.52 | 0 | 3 | -1 | 44 | 179.586 | 1 | ↓ |
| Mid Mid (pH 6-8) | 1.58 | 2.96 | -8.34 | 1 | 3 | 0 | 46 | 180.594 | 1 | ↓ |
| Lo Low (pH 4.5-6) | 1.58 | 3.38 | -37.65 | 2 | 3 | 1 | 47 | 181.602 | 1 | ↓ |
