| In ZINC since | Heavy atoms | Benign functionality |
|---|---|---|
| November 4th, 2005 | 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) | 3.90 | 0.84 | -12.92 | 0 | 7 | 0 | 83 | 443.54 | 9 | ↓ |
| Mid Mid (pH 6-8) | 4.08 | 0.04 | -13.69 | 0 | 7 | 0 | 83 | 443.54 | 9 | ↓ |
| Mid Mid (pH 6-8) | 3.90 | 1.1 | -15.74 | 0 | 7 | 0 | 83 | 443.54 | 9 | ↓ |
