| In ZINC since | Heavy atoms | Benign functionality |
|---|---|---|
| November 15th, 2008 | 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) | 1.73 | 3.51 | -9.65 | 2 | 4 | 0 | 62 | 228.251 | 3 | ↓ |
| Hi High (pH 8-9.5) | 1.73 | 4.37 | -55.24 | 1 | 4 | -1 | 65 | 227.243 | 3 | ↓ |
| Lo Low (pH 4.5-6) | 1.73 | 3.94 | -46.5 | 3 | 4 | 1 | 63 | 229.259 | 3 | ↓ |
