| In ZINC since | Heavy atoms | Benign functionality |
|---|---|---|
| August 5th, 2007 | 29 | 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) | 4.17 | 9.9 | -54.8 | 0 | 6 | -1 | 86 | 442.929 | 5 | ↓ |
| Mid Mid (pH 6-8) | 3.58 | 10.2 | -10.06 | 0 | 6 | 0 | 80 | 443.937 | 5 | ↓ |
| Mid Mid (pH 6-8) | 4.61 | 9.18 | -14.66 | 1 | 6 | 0 | 83 | 443.937 | 4 | ↓ |
