| In ZINC since | Heavy atoms | Benign functionality |
|---|---|---|
| March 25th, 2006 | 29 | 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) | 1.97 | 7.84 | -56.56 | 0 | 9 | -1 | 129 | 397.363 | 6 | ↓ |
| Mid Mid (pH 6-8) | 2.41 | -0.42 | -30.75 | 1 | 9 | 0 | 125 | 398.371 | 5 | ↓ |
| Mid Mid (pH 6-8) | 1.39 | -0.2 | -19.35 | 0 | 9 | 0 | 122 | 398.371 | 6 | ↓ |
