| In ZINC since | Heavy atoms | Benign functionality |
|---|---|---|
| November 18th, 2008 | 32 | 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) | 3.03 | 10.55 | -69.49 | 1 | 9 | 0 | 120 | 459.886 | 8 | ↓ |
| Hi High (pH 8-9.5) | 3.03 | 8.01 | -52.02 | 0 | 9 | -1 | 119 | 458.878 | 8 | ↓ |
| Lo Low (pH 4.5-6) | 3.03 | 9.73 | -58 | 2 | 9 | 1 | 117 | 460.894 | 8 | ↓ |
