| In ZINC since | Heavy atoms | Benign functionality |
|---|---|---|
| August 22nd, 2007 | 33 | 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) | 3.33 | 7.3 | -56.7 | 0 | 7 | -1 | 82 | 469.583 | 9 | ↓ |
| Mid Mid (pH 6-8) | 3.78 | 9.11 | -42.63 | 2 | 7 | 1 | 81 | 471.599 | 8 | ↓ |
| Mid Mid (pH 6-8) | 2.75 | -1.67 | -46.51 | 1 | 7 | 1 | 77 | 471.599 | 9 | ↓ |
| Mid Mid (pH 6-8) | 3.33 | 9.7 | -71.59 | 1 | 7 | 0 | 83 | 470.591 | 9 | ↓ |
