| In ZINC since | Heavy atoms | Benign functionality |
|---|---|---|
| November 25th, 2008 | 30 | Yes |
| 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) | 1.59 | 5.73 | -42.46 | 4 | 8 | 1 | 101 | 412.514 | 5 | ↓ |
| Hi High (pH 8-9.5) | 1.59 | 5.27 | -13.83 | 3 | 8 | 0 | 99 | 411.506 | 5 | ↓ |
| Hi High (pH 8-9.5) | 1.59 | 5.23 | -14.19 | 3 | 8 | 0 | 99 | 411.506 | 5 | ↓ |
| Mid Mid (pH 6-8) | 1.59 | 6.4 | -56.92 | 4 | 8 | 1 | 104 | 412.514 | 5 | ↓ |
