| In ZINC since | Heavy atoms | Benign functionality |
|---|---|---|
| April 22nd, 2006 | 26 | 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) | 3.12 | 4.66 | -13.34 | 3 | 6 | 0 | 89 | 349.39 | 4 | ↓ |
| Hi High (pH 8-9.5) | 3.10 | 4.76 | -57.54 | 1 | 6 | -1 | 88 | 348.382 | 4 | ↓ |
| Hi High (pH 8-9.5) | 3.10 | 4.97 | -46.27 | 1 | 6 | -1 | 88 | 348.382 | 4 | ↓ |
| Hi High (pH 8-9.5) | 3.12 | 5.42 | -46.85 | 2 | 6 | -1 | 92 | 348.382 | 4 | ↓ |
| Mid Mid (pH 6-8) | 3.12 | 5.29 | -52.79 | 2 | 6 | -1 | 92 | 348.382 | 4 | ↓ |
