| In ZINC since | Heavy atoms | Benign functionality |
|---|---|---|
| November 17th, 2010 | 17 | 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) | 2.00 | 6.66 | -44.85 | 3 | 2 | 1 | 41 | 227.331 | 4 | ↓ |
| Hi High (pH 8-9.5) | 2.00 | 6.4 | -5.55 | 2 | 2 | 0 | 39 | 226.323 | 4 | ↓ |
| Lo Low (pH 4.5-6) | 2.00 | 7.13 | -108.3 | 4 | 2 | 2 | 42 | 228.339 | 4 | ↓ |
