| In ZINC since | Heavy atoms | Benign functionality |
|---|---|---|
| August 27th, 2007 | 35 | 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) | 3.94 | 9.12 | -44.6 | 1 | 7 | -1 | 99 | 472.517 | 9 | ↓ |
| Mid Mid (pH 6-8) | 4.38 | 7.77 | -28.03 | 2 | 7 | 0 | 96 | 473.525 | 8 | ↓ |
| Mid Mid (pH 6-8) | 3.35 | 8.81 | -17.83 | 1 | 7 | 0 | 93 | 473.525 | 9 | ↓ |
