| In ZINC since | Heavy atoms | Benign functionality |
|---|---|---|
| November 22nd, 2009 | 16 | 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) | -2.56 | -2.42 | -51.89 | 5 | 6 | 1 | 99 | 223.256 | 5 | ↓ |
| Hi High (pH 8-9.5) | -2.38 | -3.7 | -53.54 | 4 | 6 | 0 | 105 | 222.248 | 5 | ↓ |
| Hi High (pH 8-9.5) | -2.56 | -2.8 | -7.9 | 4 | 6 | 0 | 97 | 222.248 | 5 | ↓ |
| Lo Low (pH 4.5-6) | -2.56 | -1.96 | -91.85 | 6 | 6 | 2 | 100 | 224.264 | 5 | ↓ |
