| In ZINC since | Heavy atoms | Benign functionality |
|---|---|---|
| August 6th, 2007 | 30 | 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) | 3.44 | 8.81 | -61.81 | 0 | 6 | -1 | 79 | 426.876 | 6 | ↓ |
| Mid Mid (pH 6-8) | 2.86 | 10.54 | -11.14 | 0 | 6 | 0 | 73 | 427.884 | 6 | ↓ |
| Mid Mid (pH 6-8) | 3.89 | 8.8 | -23.22 | 1 | 6 | 0 | 76 | 427.884 | 5 | ↓ |
