| In ZINC since | Heavy atoms | Benign functionality |
|---|---|---|
| October 28th, 2009 | 32 | 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) | -1.27 | -1.19 | -30.82 | 5 | 10 | 0 | 181 | 443.432 | 2 | ↓ |
| Hi High (pH 8-9.5) | -0.69 | 1.11 | -186.51 | 5 | 10 | -2 | 191 | 442.424 | 2 | ↓ |
| Hi High (pH 8-9.5) | -2.01 | -0.75 | -145.77 | 4 | 10 | -2 | 184 | 442.424 | 1 | ↓ |
| Mid Mid (pH 6-8) | -1.27 | 1.51 | -102.23 | 5 | 10 | -1 | 185 | 443.432 | 2 | ↓ |
| Mid Mid (pH 6-8) | -0.24 | 0.06 | -101.43 | 6 | 10 | -1 | 188 | 443.432 | 2 | ↓ |
| Mid Mid (pH 6-8) | -2.01 | -1.75 | -75.65 | 5 | 10 | -1 | 181 | 443.432 | 1 | ↓ |
| Mid Mid (pH 6-8) | -1.27 | 0.79 | -81.7 | 6 | 10 | 0 | 182 | 444.44 | 2 | ↓ |
