| In ZINC since | Heavy atoms | Benign functionality |
|---|---|---|
| April 2nd, 2006 | 22 | 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) | 2.95 | 7.27 | -12.22 | 3 | 5 | 0 | 69 | 310.382 | 4 | ↓ |
| Hi High (pH 8-9.5) | 3.41 | 5.31 | -44.17 | 2 | 5 | -1 | 72 | 309.374 | 4 | ↓ |
| Hi High (pH 8-9.5) | 3.41 | 5.6 | -47.06 | 2 | 5 | -1 | 72 | 309.374 | 4 | ↓ |
