| In ZINC since | Heavy atoms | Benign functionality |
|---|---|---|
| August 31st, 2009 | 31 | 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) | 4.49 | 11.7 | -63 | 2 | 5 | 1 | 60 | 453.035 | 3 | ↓ |
| Hi High (pH 8-9.5) | 4.49 | 10.34 | -12.77 | 1 | 5 | 0 | 55 | 452.027 | 3 | ↓ |
| Mid Mid (pH 6-8) | 4.49 | 12.64 | -104.88 | 3 | 5 | 2 | 61 | 454.043 | 3 | ↓ |
