| In ZINC since | Heavy atoms | Benign functionality |
|---|---|---|
| July 29th, 2007 | 35 | 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) | 3.34 | 8.56 | -60.04 | 0 | 7 | -1 | 86 | 496.653 | 8 | ↓ |
| Mid Mid (pH 6-8) | 2.75 | -1.14 | -50.22 | 1 | 7 | 1 | 81 | 498.669 | 8 | ↓ |
| Mid Mid (pH 6-8) | 3.34 | 10.9 | -74.12 | 1 | 7 | 0 | 87 | 497.661 | 8 | ↓ |
