| In ZINC since | Heavy atoms | Benign functionality |
|---|---|---|
| December 6th, 2009 | 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) | 2.58 | 4.14 | -43.45 | 3 | 8 | 1 | 97 | 473.933 | 5 | ↓ |
| Hi High (pH 8-9.5) | 2.58 | 2.44 | -46.02 | 1 | 8 | -1 | 98 | 471.917 | 5 | ↓ |
| Mid Mid (pH 6-8) | 2.58 | 1.87 | -11.55 | 2 | 8 | 0 | 96 | 472.925 | 5 | ↓ |
| Mid Mid (pH 6-8) | 2.58 | 4.72 | -31.17 | 2 | 8 | 0 | 100 | 472.925 | 5 | ↓ |
