| In ZINC since | Heavy atoms | Benign functionality |
|---|---|---|
| April 7th, 2006 | 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) | 2.32 | 7.46 | -64.57 | 0 | 7 | -1 | 88 | 408.43 | 6 | ↓ |
| Mid Mid (pH 6-8) | 2.32 | -0.71 | -14.62 | 1 | 7 | 0 | 85 | 409.438 | 6 | ↓ |
| Mid Mid (pH 6-8) | 1.74 | -0.85 | -15 | 0 | 7 | 0 | 82 | 409.438 | 6 | ↓ |
