| In ZINC since | Heavy atoms | Benign functionality |
|---|---|---|
| August 27th, 2007 | 39 | No |
| 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) | 4.06 | 10.42 | -61.48 | 0 | 8 | -1 | 95 | 529.613 | 10 | ↓ |
| Mid Mid (pH 6-8) | 4.50 | 12.38 | -49.59 | 2 | 8 | 1 | 94 | 531.629 | 9 | ↓ |
| Mid Mid (pH 6-8) | 3.47 | 12.82 | -49.11 | 1 | 8 | 1 | 90 | 531.629 | 10 | ↓ |
| Mid Mid (pH 6-8) | 4.06 | 12.76 | -83.55 | 1 | 8 | 0 | 96 | 530.621 | 10 | ↓ |
