| In ZINC since | Heavy atoms | Benign functionality |
|---|---|---|
| July 25th, 2007 | 35 | 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) | 4.58 | 9.59 | -59.46 | 0 | 8 | -1 | 105 | 489.529 | 6 | ↓ |
| Mid Mid (pH 6-8) | 3.99 | -0.3 | -14.79 | 0 | 8 | 0 | 98 | 490.537 | 6 | ↓ |
| Lo Low (pH 4.5-6) | 4.58 | 8.77 | -18.13 | 1 | 8 | 0 | 102 | 490.537 | 6 | ↓ |
