| In ZINC since | Heavy atoms | Benign functionality |
|---|---|---|
| September 11th, 2008 | 10 | 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) | -1.35 | -1.93 | -14.26 | 5 | 6 | 0 | 104 | 142.118 | 1 | ↓ |
| Hi High (pH 8-9.5) | -1.35 | -0.19 | -65.57 | 5 | 6 | 0 | 108 | 142.118 | 1 | ↓ |
| Hi High (pH 8-9.5) | -1.35 | -0.66 | -56.14 | 4 | 6 | -1 | 107 | 141.11 | 1 | ↓ |
| Mid Mid (pH 6-8) | -1.35 | -1.41 | -47.73 | 6 | 6 | 1 | 105 | 143.126 | 1 | ↓ |
