| In ZINC since | Heavy atoms | Benign functionality |
|---|---|---|
| October 7th, 2009 | 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) | 4.55 | 8.79 | -21.87 | 3 | 6 | 0 | 95 | 425.554 | 4 | ↓ |
| Ref Reference (pH 7) | 5.54 | 5.95 | -125.95 | 1 | 6 | -2 | 104 | 423.538 | 4 | ↓ |
| Mid Mid (pH 6-8) | 5.09 | 7.62 | -49.83 | 2 | 6 | -1 | 101 | 424.546 | 4 | ↓ |
| Mid Mid (pH 6-8) | 5.09 | 7.32 | -54.42 | 2 | 6 | -1 | 101 | 424.546 | 4 | ↓ |
