| In ZINC since | Heavy atoms | Benign functionality |
|---|---|---|
| February 15th, 2010 | 33 | Yes |
| 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) | 3.46 | 10.18 | -82.36 | 2 | 6 | 2 | 59 | 467.013 | 3 | ↓ |
| Hi High (pH 8-9.5) | 3.46 | 7.83 | -34.62 | 1 | 6 | 1 | 58 | 466.005 | 3 | ↓ |
| Mid Mid (pH 6-8) | 3.46 | 12.33 | -184.41 | 3 | 6 | 3 | 60 | 468.021 | 3 | ↓ |
