| In ZINC since | Heavy atoms | Benign functionality |
|---|---|---|
| May 13th, 2010 | 20 | 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) | 1.10 | 3.48 | -109.25 | 4 | 4 | 2 | 45 | 281.444 | 2 | ↓ |
| Hi High (pH 8-9.5) | 1.10 | 2.89 | -35.78 | 3 | 4 | 1 | 43 | 280.436 | 2 | ↓ |
| Hi High (pH 8-9.5) | 1.10 | 1.2 | -42.38 | 3 | 4 | 1 | 43 | 280.436 | 2 | ↓ |
