| In ZINC since | Heavy atoms | Benign functionality |
|---|---|---|
| March 30th, 2006 | 17 | 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) | 2.94 | 5.57 | -11.67 | 1 | 4 | 0 | 55 | 232.283 | 3 | ↓ |
| Hi High (pH 8-9.5) | 2.95 | 6.72 | -62.28 | 0 | 4 | -1 | 57 | 231.275 | 3 | ↓ |
| Hi High (pH 8-9.5) | 2.95 | 5.88 | -55.12 | 0 | 4 | -1 | 57 | 231.275 | 3 | ↓ |
