| In ZINC since | Heavy atoms | Benign functionality |
|---|---|---|
| February 12th, 2010 | 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) | 3.52 | 8.39 | -12.32 | 2 | 8 | 0 | 128 | 487.604 | 7 | ↓ |
| Mid Mid (pH 6-8) | 3.52 | 10.66 | -43.2 | 3 | 8 | 1 | 130 | 488.612 | 7 | ↓ |
| Lo Low (pH 4.5-6) | 3.52 | 10.46 | -89.93 | 4 | 8 | 2 | 131 | 489.62 | 7 | ↓ |
