| In ZINC since | Heavy atoms | Benign functionality |
|---|---|---|
| March 17th, 2011 | 11 | 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) | 1.60 | 1.13 | -120.27 | 6 | 2 | 2 | 55 | 160.305 | 3 | ↓ |
| Hi High (pH 8-9.5) | 1.60 | 0.86 | -38.05 | 5 | 2 | 1 | 54 | 159.297 | 3 | ↓ |
| Mid Mid (pH 6-8) | 1.60 | 0.95 | -39.84 | 5 | 2 | 1 | 54 | 159.297 | 3 | ↓ |
