| In ZINC since | Heavy atoms | Benign functionality |
|---|---|---|
| September 6th, 2008 | 33 | 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) | 5.03 | 13.49 | -74.89 | 1 | 6 | 0 | 78 | 452.595 | 13 | ↓ |
| Mid Mid (pH 6-8) | 5.48 | 12.37 | -58.06 | 2 | 6 | 1 | 75 | 453.603 | 12 | ↓ |
| Mid Mid (pH 6-8) | 4.45 | 13.39 | -52.8 | 1 | 6 | 1 | 72 | 453.603 | 13 | ↓ |
