| In ZINC since | Heavy atoms | Benign functionality |
|---|---|---|
| December 30th, 2008 | 28 | 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) | 2.80 | 9.16 | -135.65 | 4 | 5 | 2 | 59 | 403.954 | 9 | ↓ |
| Hi High (pH 8-9.5) | 2.80 | 5.89 | -10.54 | 2 | 5 | 0 | 54 | 401.938 | 9 | ↓ |
| Hi High (pH 8-9.5) | 2.80 | 7.1 | -58.77 | 3 | 5 | 1 | 58 | 402.946 | 9 | ↓ |
| Mid Mid (pH 6-8) | 2.80 | 7.9 | -43.79 | 3 | 5 | 1 | 55 | 402.946 | 9 | ↓ |
