| In ZINC since | Heavy atoms | Benign functionality |
|---|---|---|
| August 7th, 2007 | 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) | 4.47 | 10.14 | -54.31 | 0 | 8 | -1 | 101 | 519.53 | 7 | ↓ |
| Mid Mid (pH 6-8) | 4.92 | 9.71 | -21.11 | 1 | 8 | 0 | 98 | 520.538 | 6 | ↓ |
| Mid Mid (pH 6-8) | 3.89 | 10.38 | -14.07 | 0 | 8 | 0 | 95 | 520.538 | 7 | ↓ |
