| In ZINC since | Heavy atoms | Benign functionality |
|---|---|---|
| September 12th, 2008 | 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) | 3.59 | 14.21 | -47.4 | 2 | 8 | 1 | 69 | 424.573 | 3 | ↓ |
| Hi High (pH 8-9.5) | 3.59 | 9.08 | -39.84 | 2 | 8 | 1 | 69 | 424.573 | 3 | ↓ |
| Hi High (pH 8-9.5) | 3.59 | 8.82 | -13.37 | 1 | 8 | 0 | 68 | 423.565 | 3 | ↓ |
| Mid Mid (pH 6-8) | 3.59 | 11.57 | -95.65 | 3 | 8 | 2 | 70 | 425.581 | 3 | ↓ |
| Mid Mid (pH 6-8) | 3.59 | 11.55 | -110.62 | 3 | 8 | 2 | 70 | 425.581 | 3 | ↓ |
