| In ZINC since | Heavy atoms | Benign functionality |
|---|---|---|
| March 29th, 2006 | 32 | 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) | 3.84 | 11.35 | -90.86 | 4 | 7 | 2 | 83 | 489.329 | 7 | ↓ |
| Mid Mid (pH 6-8) | 3.66 | 10.99 | -42.86 | 3 | 7 | 1 | 78 | 488.321 | 7 | ↓ |
| Mid Mid (pH 6-8) | 3.84 | 10.83 | -49.87 | 3 | 7 | 1 | 82 | 488.321 | 7 | ↓ |
| Mid Mid (pH 6-8) | 3.66 | 10.48 | -18.09 | 2 | 7 | 0 | 77 | 487.313 | 7 | ↓ |
