| In ZINC since | Heavy atoms | Benign functionality |
|---|---|---|
| February 7th, 2009 | 40 | 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) | 8.43 | 20.72 | -84.55 | 2 | 4 | 2 | 27 | 556.816 | 12 | ↓ |
| Hi High (pH 8-9.5) | 8.43 | 18.16 | -42.61 | 1 | 4 | 1 | 26 | 555.808 | 12 | ↓ |
| Hi High (pH 8-9.5) | 8.43 | 18.16 | -37.8 | 1 | 4 | 1 | 26 | 555.808 | 12 | ↓ |
| Hi High (pH 8-9.5) | 8.43 | 15.61 | -8.9 | 0 | 4 | 0 | 25 | 554.8 | 12 | ↓ |
