| In ZINC since | Heavy atoms | Benign functionality |
|---|---|---|
| August 23rd, 2007 | 38 | 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) | 4.97 | 13.05 | -60.59 | 0 | 7 | -1 | 88 | 512.582 | 9 | ↓ |
| Mid Mid (pH 6-8) | 4.39 | -0.06 | -12.91 | 0 | 7 | 0 | 82 | 513.59 | 9 | ↓ |
| Mid Mid (pH 6-8) | 5.42 | 12.13 | -18.83 | 1 | 7 | 0 | 85 | 513.59 | 8 | ↓ |
