| In ZINC since | Heavy atoms | Benign functionality |
|---|---|---|
| August 15th, 2007 | 31 | 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) | 4.92 | 7.45 | -15.17 | 3 | 6 | 0 | 89 | 439.943 | 6 | ↓ |
| Ref Reference (pH 7) | 4.92 | 6.8 | -12.48 | 3 | 6 | 0 | 89 | 439.943 | 6 | ↓ |
| Hi High (pH 8-9.5) | 4.90 | 7.61 | -42.59 | 1 | 6 | -1 | 88 | 438.935 | 6 | ↓ |
| Hi High (pH 8-9.5) | 4.90 | 7.13 | -51.34 | 1 | 6 | -1 | 88 | 438.935 | 6 | ↓ |
| Hi High (pH 8-9.5) | 4.92 | 7.63 | -38.8 | 2 | 6 | -1 | 92 | 438.935 | 6 | ↓ |
| Mid Mid (pH 6-8) | 4.92 | 7.57 | -50.81 | 2 | 6 | -1 | 92 | 438.935 | 6 | ↓ |
