| In ZINC since | Heavy atoms | Benign functionality |
|---|---|---|
| September 29th, 2009 | 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) | 3.66 | 10.33 | -19.48 | 2 | 7 | 0 | 90 | 506.605 | 8 | ↓ |
| Hi High (pH 8-9.5) | 3.73 | 9.45 | -117.98 | 0 | 7 | -2 | 99 | 504.589 | 8 | ↓ |
| Mid Mid (pH 6-8) | 3.73 | 8.67 | -58.79 | 1 | 7 | -1 | 96 | 505.597 | 8 | ↓ |
