| In ZINC since | Heavy atoms | Benign functionality |
|---|---|---|
| July 25th, 2004 | 37 | 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) | 4.67 | 12.08 | -56.15 | 0 | 8 | -1 | 105 | 512.567 | 8 | ↓ |
| Mid Mid (pH 6-8) | 5.12 | 0.37 | -26.58 | 1 | 8 | 0 | 101 | 513.575 | 7 | ↓ |
| Mid Mid (pH 6-8) | 4.08 | 0.59 | -16.91 | 0 | 8 | 0 | 98 | 513.575 | 8 | ↓ |
