| In ZINC since | Heavy atoms | Benign functionality |
|---|---|---|
| November 11th, 2008 | 12 | 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) | 0.03 | 0.35 | -40.18 | 3 | 3 | 1 | 40 | 173.28 | 4 | ↓ |
| Hi High (pH 8-9.5) | 0.03 | 2.93 | -25.39 | 3 | 3 | 1 | 40 | 173.28 | 4 | ↓ |
| Lo Low (pH 4.5-6) | 0.03 | 2.61 | -103.62 | 4 | 3 | 2 | 41 | 174.288 | 4 | ↓ |
