| In ZINC since | Heavy atoms | Benign functionality |
|---|---|---|
| September 1st, 2009 | 25 | 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) | 1.27 | 10.21 | -111.11 | 2 | 6 | 0 | 82 | 361.829 | 2 | ↓ |
| Hi High (pH 8-9.5) | 1.27 | 8.97 | -65.71 | 1 | 6 | -1 | 77 | 360.821 | 2 | ↓ |
| Lo Low (pH 4.5-6) | -1.48 | 7.32 | -84.09 | 3 | 6 | 1 | 85 | 362.837 | 1 | ↓ |
