| In ZINC since | Heavy atoms | Benign functionality |
|---|---|---|
| July 17th, 2009 | 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) | 0.63 | 7.02 | -54.36 | 3 | 9 | -1 | 137 | 501.515 | 8 | ↓ |
| Hi High (pH 8-9.5) | 0.63 | 7.21 | -56.19 | 4 | 9 | 0 | 142 | 502.523 | 8 | ↓ |
| Hi High (pH 8-9.5) | 0.82 | 3.44 | -121.02 | 2 | 9 | -2 | 143 | 500.507 | 8 | ↓ |
| Mid Mid (pH 6-8) | 0.82 | 5.47 | -88.71 | 3 | 9 | -1 | 148 | 501.515 | 8 | ↓ |
| Mid Mid (pH 6-8) | 0.82 | 5.68 | -75.17 | 3 | 9 | -1 | 148 | 501.515 | 8 | ↓ |
