| In ZINC since | Heavy atoms | Benign functionality |
|---|---|---|
| August 24th, 2007 | 34 | 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) | 5.12 | 11.5 | -66.03 | 0 | 7 | -1 | 96 | 473.53 | 6 | ↓ |
| Mid Mid (pH 6-8) | 4.54 | 0.1 | -21.12 | 0 | 7 | 0 | 89 | 474.538 | 6 | ↓ |
| Mid Mid (pH 6-8) | 5.57 | 10.4 | -35.32 | 1 | 7 | 0 | 93 | 474.538 | 5 | ↓ |
