| In ZINC since | Heavy atoms | Benign functionality |
|---|---|---|
| March 1st, 2010 | 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) | 3.00 | 5.77 | -22.68 | 2 | 8 | 0 | 104 | 448.932 | 7 | ↓ |
| Mid Mid (pH 6-8) | 3.46 | 5.4 | -55.6 | 2 | 8 | 0 | 109 | 448.932 | 7 | ↓ |
| Mid Mid (pH 6-8) | 1.91 | 7.5 | -52.39 | 2 | 8 | 1 | 103 | 449.94 | 7 | ↓ |
