| In ZINC since | Heavy atoms | Benign functionality |
|---|---|---|
| July 13th, 2011 | 17 | 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) | 1.48 | 9.96 | -42.74 | 1 | 3 | 1 | 22 | 228.319 | 3 | ↓ |
| Hi High (pH 8-9.5) | 1.48 | 7.52 | -6.18 | 0 | 3 | 0 | 21 | 227.311 | 3 | ↓ |
| Lo Low (pH 4.5-6) | 1.48 | 10.47 | -80.92 | 2 | 3 | 2 | 24 | 229.327 | 3 | ↓ |
