| In ZINC since | Heavy atoms | Benign functionality |
|---|---|---|
| December 9th, 2008 | 16 | 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) | 1.02 | 3.78 | -51.75 | 3 | 4 | 1 | 59 | 222.312 | 6 | ↓ |
| Hi High (pH 8-9.5) | 1.02 | 2.37 | -11.96 | 2 | 4 | 0 | 54 | 221.304 | 6 | ↓ |
| Lo Low (pH 4.5-6) | 1.02 | 2.92 | -36.32 | 3 | 4 | 1 | 55 | 222.312 | 6 | ↓ |
