| In ZINC since | Heavy atoms | Benign functionality |
|---|---|---|
| December 9th, 2008 | 18 | 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) | 1.72 | 4.69 | -52.23 | 3 | 4 | 1 | 59 | 248.35 | 5 | ↓ |
| Hi High (pH 8-9.5) | 1.72 | 3.3 | -12.1 | 2 | 4 | 0 | 54 | 247.342 | 5 | ↓ |
| Lo Low (pH 4.5-6) | 1.72 | 3.84 | -36.4 | 3 | 4 | 1 | 55 | 248.35 | 5 | ↓ |
