| In ZINC since | Heavy atoms | Benign functionality |
|---|---|---|
| May 29th, 2008 | 30 | 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) | 3.99 | 5.43 | -13.87 | 3 | 7 | 0 | 99 | 427.888 | 5 | ↓ |
| Ref Reference (pH 7) | 3.99 | 5.2 | -12.89 | 3 | 7 | 0 | 99 | 427.888 | 5 | ↓ |
| Hi High (pH 8-9.5) | 3.97 | 5.84 | -48.19 | 1 | 7 | -1 | 98 | 426.88 | 5 | ↓ |
| Hi High (pH 8-9.5) | 3.97 | 5.79 | -50.84 | 1 | 7 | -1 | 98 | 426.88 | 5 | ↓ |
| Hi High (pH 8-9.5) | 3.99 | 6.18 | -35.97 | 2 | 7 | -1 | 102 | 426.88 | 5 | ↓ |
| Mid Mid (pH 6-8) | 3.99 | 5.97 | -49.68 | 2 | 7 | -1 | 102 | 426.88 | 5 | ↓ |
