| In ZINC since | Heavy atoms | Benign functionality |
|---|---|---|
| July 25th, 2007 | 39 | 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) | 4.42 | 10.29 | -63.62 | 1 | 8 | -1 | 108 | 530.597 | 12 | ↓ |
| Mid Mid (pH 6-8) | 4.87 | 9.62 | -22.82 | 2 | 8 | 0 | 106 | 531.605 | 11 | ↓ |
| Mid Mid (pH 6-8) | 3.84 | 10.61 | -15.57 | 1 | 8 | 0 | 102 | 531.605 | 12 | ↓ |
