| In ZINC since | Heavy atoms | Benign functionality |
|---|---|---|
| August 8th, 2007 | 35 | 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) | 3.38 | 7.87 | -62.12 | 0 | 8 | -1 | 107 | 499.609 | 9 | ↓ |
| Mid Mid (pH 6-8) | 2.80 | -2.75 | -14.7 | 0 | 8 | 0 | 101 | 500.617 | 9 | ↓ |
| Lo Low (pH 4.5-6) | 3.38 | 7.05 | -17.5 | 1 | 8 | 0 | 104 | 500.617 | 9 | ↓ |
