| In ZINC since | Heavy atoms | Benign functionality |
|---|---|---|
| July 20th, 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) | 2.42 | 7.79 | -31.72 | 2 | 2 | 1 | 16 | 231.363 | 5 | ↓ |
| Hi High (pH 8-9.5) | 2.42 | 5.45 | -2.17 | 1 | 2 | 0 | 15 | 230.355 | 5 | ↓ |
| Hi High (pH 8-9.5) | 2.42 | 6.65 | -42.3 | 2 | 2 | 1 | 20 | 231.363 | 5 | ↓ |
| Lo Low (pH 4.5-6) | 2.42 | 8.99 | -111.76 | 3 | 2 | 2 | 21 | 232.371 | 5 | ↓ |
