| In ZINC since | Heavy atoms | Benign functionality |
|---|---|---|
| November 2nd, 2008 | 16 | 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) | 0.67 | 2.07 | -36.19 | 4 | 5 | 1 | 66 | 229.348 | 6 | ↓ |
| Hi High (pH 8-9.5) | 0.67 | -0.19 | -8.35 | 3 | 5 | 0 | 65 | 228.34 | 6 | ↓ |
| Hi High (pH 8-9.5) | 0.67 | -0.55 | -6.18 | 3 | 5 | 0 | 65 | 228.34 | 6 | ↓ |
| Mid Mid (pH 6-8) | 0.67 | 2.13 | -39.99 | 4 | 5 | 1 | 66 | 229.348 | 6 | ↓ |
| Lo Low (pH 4.5-6) | 0.67 | 1.75 | -79.62 | 5 | 5 | 2 | 68 | 230.356 | 6 | ↓ |
| Lo Low (pH 4.5-6) | 0.67 | 1.67 | -78.97 | 5 | 5 | 2 | 68 | 230.356 | 6 | ↓ |
