| In ZINC since | Heavy atoms | Benign functionality |
|---|---|---|
| July 25th, 2007 | 36 | 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) | 5.55 | 11.59 | -58.82 | 0 | 7 | -1 | 92 | 499.568 | 6 | ↓ |
| Mid Mid (pH 6-8) | 4.96 | -0.06 | -12.96 | 0 | 7 | 0 | 85 | 500.576 | 6 | ↓ |
| Lo Low (pH 4.5-6) | 5.55 | 10.77 | -16.14 | 1 | 7 | 0 | 89 | 500.576 | 6 | ↓ |
