| In ZINC since | Heavy atoms | Benign functionality |
|---|---|---|
| March 16th, 2010 | 33 | 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) | 5.50 | 14.06 | -42.58 | 1 | 5 | 1 | 35 | 449.663 | 9 | ↓ |
| Mid Mid (pH 6-8) | 5.50 | 14.91 | -87.41 | 2 | 5 | 2 | 36 | 450.671 | 9 | ↓ |
| Mid Mid (pH 6-8) | 5.50 | 13.96 | -38.48 | 1 | 5 | 1 | 35 | 449.663 | 9 | ↓ |
| Mid Mid (pH 6-8) | 5.50 | 11.7 | -10.42 | 0 | 5 | 0 | 34 | 448.655 | 9 | ↓ |
