| In ZINC since | Heavy atoms | Benign functionality |
|---|---|---|
| April 15th, 2010 | 13 | 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) | -2.42 | -5.64 | -55.35 | 5 | 6 | 1 | 89 | 209.295 | 4 | ↓ |
| Hi High (pH 8-9.5) | -2.42 | -6.03 | -8.65 | 4 | 6 | 0 | 87 | 208.287 | 4 | ↓ |
| Mid Mid (pH 6-8) | -2.42 | -4.69 | -75.75 | 5 | 6 | 1 | 96 | 209.295 | 4 | ↓ |
| Mid Mid (pH 6-8) | -2.42 | -6.01 | -46.01 | 4 | 6 | 0 | 91 | 208.287 | 4 | ↓ |
| Mid Mid (pH 6-8) | -2.42 | -4.38 | -118.92 | 6 | 6 | 2 | 94 | 210.303 | 4 | ↓ |
