| In ZINC since | Heavy atoms | Benign functionality |
|---|---|---|
| March 13th, 2010 | 30 | 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) | 1.18 | 5.78 | -61.85 | 0 | 8 | -1 | 99 | 411.434 | 7 | ↓ |
| Mid Mid (pH 6-8) | 1.18 | 8.05 | -71.39 | 1 | 8 | 0 | 100 | 412.442 | 7 | ↓ |
| Lo Low (pH 4.5-6) | 1.18 | 7.17 | -47.85 | 2 | 8 | 1 | 98 | 413.45 | 7 | ↓ |
