| In ZINC since | Heavy atoms | Benign functionality |
|---|---|---|
| November 2nd, 2008 | 22 | 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) | 3.25 | 10.48 | -82.59 | 2 | 3 | 2 | 12 | 323.55 | 4 | ↓ |
| Hi High (pH 8-9.5) | 3.25 | 8.01 | -34.61 | 1 | 3 | 1 | 11 | 322.542 | 4 | ↓ |
| Hi High (pH 8-9.5) | 3.25 | 6.54 | -2.74 | 0 | 3 | 0 | 10 | 321.534 | 4 | ↓ |
| Mid Mid (pH 6-8) | 3.25 | 8.12 | -36.52 | 1 | 3 | 1 | 11 | 322.542 | 4 | ↓ |
| Mid Mid (pH 6-8) | 3.25 | 9.59 | -102.73 | 2 | 3 | 2 | 12 | 323.55 | 4 | ↓ |
