| In ZINC since | Heavy atoms | Benign functionality |
|---|---|---|
| September 28th, 2008 | 29 | 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) | 4.31 | 7.47 | -17.54 | 1 | 6 | 0 | 72 | 424.448 | 6 | ↓ |
| Ref Reference (pH 7) | 4.25 | 8.63 | -18.93 | 1 | 6 | 0 | 69 | 424.448 | 6 | ↓ |
| Mid Mid (pH 6-8) | 4.77 | 7.68 | -44.05 | 0 | 6 | -1 | 75 | 423.44 | 6 | ↓ |
| Mid Mid (pH 6-8) | 4.31 | 7.34 | -16.52 | 1 | 6 | 0 | 72 | 424.448 | 6 | ↓ |
