| In ZINC since | Heavy atoms | Benign functionality |
|---|---|---|
| May 18th, 2008 | 27 | 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) | 3.55 | 5.33 | -23.75 | 3 | 7 | 0 | 103 | 429.274 | 4 | ↓ |
| Hi High (pH 8-9.5) | 4.01 | 3.44 | -61.39 | 2 | 7 | -1 | 107 | 428.266 | 4 | ↓ |
| Hi High (pH 8-9.5) | 4.01 | 3.75 | -46.97 | 2 | 7 | -1 | 107 | 428.266 | 4 | ↓ |
