| In ZINC since | Heavy atoms | Benign functionality |
|---|---|---|
| July 18th, 2009 | 33 | 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) | 3.50 | 7.18 | -58.66 | 1 | 8 | -1 | 112 | 515.336 | 8 | ↓ |
| Hi High (pH 8-9.5) | 3.50 | 7.94 | -112.09 | 0 | 8 | -2 | 115 | 514.328 | 8 | ↓ |
| Lo Low (pH 4.5-6) | 3.50 | 6.22 | -16.92 | 2 | 8 | 0 | 109 | 516.344 | 8 | ↓ |
