| In ZINC since | Heavy atoms | Benign functionality |
|---|---|---|
| February 25th, 2009 | 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) | 3.53 | 8.45 | -13.85 | 1 | 8 | 0 | 86 | 480.561 | 11 | ↓ |
| Hi High (pH 8-9.5) | 3.53 | 7.72 | -53.09 | 0 | 8 | -1 | 89 | 479.553 | 11 | ↓ |
| Mid Mid (pH 6-8) | 3.53 | 9.49 | -57.8 | 2 | 8 | 1 | 88 | 481.569 | 11 | ↓ |
