| In ZINC since | Heavy atoms | Benign functionality |
|---|---|---|
| April 7th, 2006 | 30 | 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) | 1.39 | 3.59 | -61.67 | 1 | 8 | -1 | 108 | 410.402 | 6 | ↓ |
| Mid Mid (pH 6-8) | 1.39 | -2.77 | -15.89 | 2 | 8 | 0 | 105 | 411.41 | 6 | ↓ |
| Mid Mid (pH 6-8) | 0.81 | -2.89 | -16.18 | 1 | 8 | 0 | 102 | 411.41 | 6 | ↓ |
