| In ZINC since | Heavy atoms | Benign functionality |
|---|---|---|
| September 10th, 2008 | 31 | Yes |
| 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) | 3.81 | 9.05 | -19.62 | 2 | 8 | 0 | 116 | 450.549 | 5 | ↓ |
| Mid Mid (pH 6-8) | 3.81 | 9.28 | -15.85 | 2 | 8 | 0 | 116 | 450.549 | 5 | ↓ |
| Mid Mid (pH 6-8) | 4.27 | 7.8 | -46.72 | 1 | 8 | -1 | 120 | 449.541 | 5 | ↓ |
