| In ZINC since | Heavy atoms | Benign functionality |
|---|---|---|
| September 16th, 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) | 2.44 | 7.11 | -64.05 | 0 | 8 | -1 | 97 | 440.472 | 9 | ↓ |
| Mid Mid (pH 6-8) | 1.86 | 7.73 | -13.09 | 0 | 8 | 0 | 91 | 441.48 | 9 | ↓ |
| Lo Low (pH 4.5-6) | 2.44 | 6.29 | -20.19 | 1 | 8 | 0 | 95 | 441.48 | 9 | ↓ |
