| In ZINC since | Heavy atoms | Benign functionality |
|---|---|---|
| February 18th, 2006 | 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) | 3.86 | 10.04 | -58.2 | 0 | 5 | -1 | 70 | 410.877 | 5 | ↓ |
| Mid Mid (pH 6-8) | 4.30 | -0.91 | -23.92 | 1 | 5 | 0 | 66 | 411.885 | 4 | ↓ |
| Mid Mid (pH 6-8) | 3.27 | -0.61 | -18.15 | 0 | 5 | 0 | 63 | 411.885 | 5 | ↓ |
