| In ZINC since | Heavy atoms | Benign functionality |
|---|---|---|
| July 18th, 2009 | 34 | 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) | 3.11 | 8.46 | -51.17 | 1 | 8 | -1 | 116 | 472.502 | 5 | ↓ |
| Hi High (pH 8-9.5) | 3.11 | 9.25 | -110.92 | 0 | 8 | -2 | 119 | 471.494 | 5 | ↓ |
| Lo Low (pH 4.5-6) | 3.11 | 7.16 | -21.36 | 2 | 8 | 0 | 113 | 473.51 | 5 | ↓ |
