| In ZINC since | Heavy atoms | Benign functionality |
|---|---|---|
| February 16th, 2009 | 14 | 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) | 2.54 | 2.33 | -8.6 | 3 | 3 | 0 | 59 | 226.688 | 1 | ↓ |
| Hi High (pH 8-9.5) | 2.54 | 2.98 | -45.72 | 2 | 3 | -1 | 62 | 225.68 | 1 | ↓ |
| Mid Mid (pH 6-8) | 2.54 | 2.66 | -35.01 | 4 | 3 | 1 | 60 | 227.696 | 1 | ↓ |
