| In ZINC since | Heavy atoms | Benign functionality |
|---|---|---|
| April 1st, 2010 | 16 | 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) | -0.39 | 0.11 | -58.3 | 4 | 4 | 1 | 77 | 241.336 | 3 | ↓ |
| Hi High (pH 8-9.5) | -0.39 | -1.1 | -11.54 | 3 | 4 | 0 | 72 | 240.328 | 3 | ↓ |
| Mid Mid (pH 6-8) | -0.39 | -0.73 | -65.5 | 4 | 4 | 1 | 74 | 241.336 | 3 | ↓ |
| Lo Low (pH 4.5-6) | -0.39 | 0.41 | -154.86 | 5 | 4 | 2 | 78 | 242.344 | 3 | ↓ |
