| In ZINC since | Heavy atoms | Benign functionality |
|---|---|---|
| September 15th, 2008 | 32 | 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) | 2.40 | 5.17 | -65.17 | 1 | 8 | -1 | 108 | 440.472 | 9 | ↓ |
| Mid Mid (pH 6-8) | 1.82 | 5.8 | -15.1 | 1 | 8 | 0 | 102 | 441.48 | 9 | ↓ |
| Lo Low (pH 4.5-6) | 2.40 | 4.35 | -20.84 | 2 | 8 | 0 | 106 | 441.48 | 9 | ↓ |
