| In ZINC since | Heavy atoms | Benign functionality |
|---|---|---|
| August 16th, 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) | 3.31 | 8.22 | -57.06 | 0 | 7 | -1 | 82 | 467.517 | 9 | ↓ |
| Mid Mid (pH 6-8) | 2.72 | 0.2 | -50.72 | 1 | 7 | 1 | 77 | 469.533 | 9 | ↓ |
| Mid Mid (pH 6-8) | 3.75 | 10.45 | -49.05 | 2 | 7 | 1 | 81 | 469.533 | 8 | ↓ |
| Mid Mid (pH 6-8) | 3.31 | 10.57 | -72.27 | 1 | 7 | 0 | 83 | 468.525 | 9 | ↓ |
