| In ZINC since | Heavy atoms | Benign functionality |
|---|---|---|
| November 12th, 2008 | 20 | 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) | 3.45 | 4.34 | -48.15 | 4 | 3 | 1 | 57 | 274.384 | 3 | ↓ |
| Hi High (pH 8-9.5) | 3.45 | 5.29 | -50.72 | 3 | 3 | 0 | 60 | 273.376 | 3 | ↓ |
| Hi High (pH 8-9.5) | 3.45 | 5.13 | -69.11 | 3 | 3 | 0 | 60 | 273.376 | 3 | ↓ |
