| In ZINC since | Heavy atoms | Benign functionality |
|---|---|---|
| April 15th, 2006 | 27 | 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) | 3.33 | 8.09 | -62.54 | 0 | 5 | -1 | 70 | 402.879 | 5 | ↓ |
| Mid Mid (pH 6-8) | 3.78 | 6.98 | -30.62 | 1 | 5 | 0 | 67 | 403.887 | 4 | ↓ |
| Mid Mid (pH 6-8) | 2.75 | 7.95 | -23.24 | 0 | 5 | 0 | 64 | 403.887 | 5 | ↓ |
