| In ZINC since | Heavy atoms | Benign functionality |
|---|---|---|
| August 31st, 2009 | 32 | 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) | 3.50 | 8.78 | -64.17 | 3 | 6 | 1 | 80 | 462.986 | 3 | ↓ |
| Hi High (pH 8-9.5) | 3.50 | 7.41 | -13.95 | 2 | 6 | 0 | 75 | 461.978 | 3 | ↓ |
| Mid Mid (pH 6-8) | 3.50 | 9.71 | -107.87 | 4 | 6 | 2 | 82 | 463.994 | 3 | ↓ |
