| In ZINC since | Heavy atoms | Benign functionality |
|---|---|---|
| April 29th, 2010 | 17 | Yes |
| 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) | 1.87 | 5.47 | -32.78 | 3 | 4 | 1 | 47 | 235.355 | 2 | ↓ |
| Hi High (pH 8-9.5) | 1.87 | 3.38 | -4.97 | 2 | 4 | 0 | 45 | 234.347 | 2 | ↓ |
| Lo Low (pH 4.5-6) | 1.87 | 5.79 | -83.69 | 4 | 4 | 2 | 48 | 236.363 | 2 | ↓ |
