| In ZINC since | Heavy atoms | Benign functionality |
|---|---|---|
| September 27th, 2008 | 16 | 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) | 2.07 | 0.86 | -35.31 | 6 | 6 | 1 | 112 | 283.109 | 2 | ↓ |
| Ref Reference (pH 7) | 2.39 | 2.75 | -95.71 | 7 | 6 | 2 | 109 | 284.117 | 2 | ↓ |
| Hi High (pH 8-9.5) | 1.62 | 0.79 | -35.8 | 5 | 6 | 0 | 112 | 282.101 | 2 | ↓ |
| Mid Mid (pH 6-8) | 1.16 | 2.51 | -11.66 | 5 | 6 | 0 | 107 | 282.101 | 2 | ↓ |
