| In ZINC since | Heavy atoms | Benign functionality |
|---|---|---|
| August 6th, 2007 | 27 | 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) | 3.46 | 8.09 | -62.43 | 0 | 5 | -1 | 70 | 447.33 | 5 | ↓ |
| Mid Mid (pH 6-8) | 2.88 | 8.48 | -11.72 | 0 | 5 | 0 | 64 | 448.338 | 5 | ↓ |
| Mid Mid (pH 6-8) | 3.91 | 8.49 | -14.34 | 1 | 5 | 0 | 67 | 448.338 | 4 | ↓ |
