| In ZINC since | Heavy atoms | Benign functionality |
|---|---|---|
| November 19th, 2011 | 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) | 1.52 | 2.79 | -30.64 | 3 | 4 | 1 | 49 | 281.42 | 6 | ↓ |
| Hi High (pH 8-9.5) | 1.52 | 1.66 | -3.24 | 2 | 4 | 0 | 45 | 280.412 | 6 | ↓ |
| Lo Low (pH 4.5-6) | 1.52 | 4.45 | -104.79 | 4 | 4 | 2 | 51 | 282.428 | 6 | ↓ |
