| In ZINC since | Heavy atoms | Benign functionality |
|---|---|---|
| August 27th, 2007 | 36 | 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) | 5.22 | 11.87 | -54.89 | 0 | 7 | -1 | 92 | 517.97 | 4 | ↓ |
| Mid Mid (pH 6-8) | 5.67 | 10.87 | -28.47 | 1 | 7 | 0 | 89 | 518.978 | 3 | ↓ |
| Mid Mid (pH 6-8) | 4.64 | 11.88 | -19.67 | 0 | 7 | 0 | 86 | 518.978 | 4 | ↓ |
| Mid Mid (pH 6-8) | 1.39 | 5.59 | -11.46 | 1 | 5 | 0 | 54 | 357.479 | 5 | ↓ |
| Mid Mid (pH 6-8) | 1.39 | 7.88 | -46.65 | 2 | 5 | 1 | 56 | 358.487 | 5 | ↓ |
