| In ZINC since | Heavy atoms | Benign functionality |
|---|---|---|
| December 22nd, 2008 | 13 | 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) | -1.89 | -3.26 | -95.01 | 6 | 4 | 2 | 62 | 188.319 | 4 | ↓ |
| Hi High (pH 8-9.5) | -1.89 | -1.3 | -88.84 | 6 | 4 | 2 | 61 | 188.319 | 4 | ↓ |
| Hi High (pH 8-9.5) | -1.89 | -3.38 | -43.02 | 5 | 4 | 1 | 60 | 187.311 | 4 | ↓ |
| Mid Mid (pH 6-8) | -1.89 | -1.14 | -183.72 | 7 | 4 | 3 | 63 | 189.327 | 4 | ↓ |
| Mid Mid (pH 6-8) | -1.89 | -1.31 | -113.38 | 6 | 4 | 2 | 61 | 188.319 | 4 | ↓ |
