| In ZINC since | Heavy atoms | Benign functionality |
|---|---|---|
| September 30th, 2008 | 30 | 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) | 3.66 | 8.54 | -63.51 | 1 | 6 | -1 | 90 | 408.474 | 7 | ↓ |
| Mid Mid (pH 6-8) | 3.66 | 8.48 | -12.33 | 2 | 6 | 0 | 87 | 409.482 | 7 | ↓ |
| Mid Mid (pH 6-8) | 3.08 | 8.87 | -11.78 | 1 | 6 | 0 | 84 | 409.482 | 7 | ↓ |
