| In ZINC since | Heavy atoms | Benign functionality |
|---|---|---|
| January 1st, 2006 | 16 | 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) | 4.77 | 0.78 | -3.39 | 2 | 2 | 0 | 40 | 222.328 | 2 | ↓ |
| Ref Reference (pH 7) | 3.02 | 5.85 | -4.69 | 1 | 2 | 0 | 37 | 222.328 | 2 | ↓ |
| Ref Reference (pH 7) | 3.02 | 5.9 | -4.7 | 1 | 2 | 0 | 37 | 222.328 | 2 | ↓ |
| Hi High (pH 8-9.5) | 3.02 | 6.44 | -54.18 | 0 | 2 | -1 | 40 | 221.32 | 2 | ↓ |
| Hi High (pH 8-9.5) | 3.02 | 6.48 | -54.21 | 0 | 2 | -1 | 40 | 221.32 | 2 | ↓ |
