| In ZINC since | Heavy atoms | Benign functionality |
|---|---|---|
| December 20th, 2005 | 24 | 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) | 2.65 | 4.99 | -20.02 | 3 | 8 | 0 | 110 | 324.344 | 3 | ↓ |
| Ref Reference (pH 7) | 2.65 | 3.67 | -16.64 | 3 | 8 | 0 | 110 | 324.344 | 3 | ↓ |
| Hi High (pH 8-9.5) | 3.11 | 2.53 | -46.75 | 2 | 8 | -1 | 113 | 323.336 | 3 | ↓ |
| Hi High (pH 8-9.5) | 3.11 | 3.64 | -48.7 | 2 | 8 | -1 | 113 | 323.336 | 3 | ↓ |
