| In ZINC since | Heavy atoms | Benign functionality |
|---|---|---|
| August 27th, 2007 | 37 | 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) | 5.62 | 13.33 | -62.08 | 0 | 6 | -1 | 79 | 498.599 | 11 | ↓ |
| Mid Mid (pH 6-8) | 6.07 | 12.25 | -29.73 | 1 | 6 | 0 | 76 | 499.607 | 10 | ↓ |
| Mid Mid (pH 6-8) | 5.04 | 13.23 | -24.66 | 0 | 6 | 0 | 73 | 499.607 | 11 | ↓ |
