| In ZINC since | Heavy atoms | Benign functionality |
|---|---|---|
| November 16th, 2009 | 13 | 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) | -2.35 | -3.91 | -60.31 | 5 | 6 | 1 | 106 | 186.191 | 4 | ↓ |
| Hi High (pH 8-9.5) | -2.35 | -5.18 | -16.36 | 4 | 6 | 0 | 101 | 185.183 | 4 | ↓ |
| Hi High (pH 8-9.5) | -2.35 | -5.18 | -14.11 | 4 | 6 | 0 | 101 | 185.183 | 4 | ↓ |
| Mid Mid (pH 6-8) | -2.17 | -6.39 | -52.27 | 4 | 6 | 0 | 112 | 185.183 | 4 | ↓ |
| Mid Mid (pH 6-8) | -2.17 | -6.39 | -52.28 | 4 | 6 | 0 | 112 | 185.183 | 4 | ↓ |
