| In ZINC since | Heavy atoms | Benign functionality |
|---|---|---|
| February 14th, 2006 | 14 | 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) | 1.71 | 4.56 | -48.77 | 1 | 4 | -1 | 69 | 207.234 | 2 | ↓ |
| Hi High (pH 8-9.5) | 1.71 | 5.1 | -93.72 | 1 | 4 | -2 | 69 | 206.226 | 2 | ↓ |
| Lo Low (pH 4.5-6) | 1.71 | 4.99 | -55.13 | 2 | 4 | 0 | 70 | 208.242 | 2 | ↓ |
