| In ZINC since | Heavy atoms | Benign functionality |
|---|---|---|
| February 5th, 2010 | 11 | 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) | 0.43 | -0.51 | -48.5 | 5 | 3 | 1 | 60 | 173.623 | 2 | ↓ |
| Hi High (pH 8-9.5) | 0.43 | 0.46 | -40.65 | 3 | 3 | -1 | 61 | 171.607 | 2 | ↓ |
| Mid Mid (pH 6-8) | 0.43 | -0.31 | -5.12 | 4 | 3 | 0 | 58 | 172.615 | 2 | ↓ |
