| In ZINC since | Heavy atoms | Benign functionality |
|---|---|---|
| September 16th, 2008 | 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) | 2.55 | 9.56 | -68.51 | 1 | 5 | 0 | 65 | 368.408 | 6 | ↓ |
| Hi High (pH 8-9.5) | 2.55 | 7.03 | -55.7 | 0 | 5 | -1 | 64 | 367.4 | 6 | ↓ |
| Mid Mid (pH 6-8) | 2.99 | 8.87 | -49.8 | 2 | 5 | 1 | 62 | 369.416 | 5 | ↓ |
| Mid Mid (pH 6-8) | 1.96 | 9.77 | -45.05 | 1 | 5 | 1 | 59 | 369.416 | 6 | ↓ |
