| In ZINC since | Heavy atoms | Benign functionality |
|---|---|---|
| November 10th, 2009 | 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) | 3.57 | 4.37 | -11.91 | 3 | 7 | 0 | 106 | 408.845 | 4 | ↓ |
| Mid Mid (pH 6-8) | 3.57 | 3.6 | -11.98 | 3 | 7 | 0 | 106 | 408.845 | 4 | ↓ |
| Lo Low (pH 4.5-6) | 3.57 | 4.02 | -44.61 | 4 | 7 | 1 | 108 | 409.853 | 4 | ↓ |
