| In ZINC since | Heavy atoms | Benign functionality |
|---|---|---|
| August 16th, 2007 | 32 | 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) | 5.14 | 11.72 | -58.42 | 0 | 5 | -1 | 70 | 452.958 | 6 | ↓ |
| Mid Mid (pH 6-8) | 5.58 | 10.51 | -29.42 | 1 | 5 | 0 | 67 | 453.966 | 5 | ↓ |
| Mid Mid (pH 6-8) | 4.55 | -0.18 | -19.31 | 0 | 5 | 0 | 63 | 453.966 | 6 | ↓ |
