| In ZINC since | Heavy atoms | Benign functionality |
|---|---|---|
| November 16th, 2008 | 28 | 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) | 3.40 | 9.08 | -36.8 | 3 | 4 | 1 | 46 | 408.9 | 7 | ↓ |
| Hi High (pH 8-9.5) | 3.40 | 8.26 | -56.93 | 3 | 4 | 1 | 49 | 408.9 | 7 | ↓ |
| Hi High (pH 8-9.5) | 3.40 | 6.97 | -11.82 | 2 | 4 | 0 | 44 | 407.892 | 7 | ↓ |
