| In ZINC since | Heavy atoms | Benign functionality |
|---|---|---|
| August 27th, 2007 | 36 | Yes |
| 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) | 6.55 | 12.43 | -13.78 | 2 | 6 | 0 | 78 | 502.014 | 7 | ↓ |
| Ref Reference (pH 7) | 6.55 | 12.11 | -12.02 | 2 | 6 | 0 | 78 | 502.014 | 7 | ↓ |
| Hi High (pH 8-9.5) | 6.53 | 12.69 | -42.2 | 0 | 6 | -1 | 77 | 501.006 | 7 | ↓ |
| Hi High (pH 8-9.5) | 6.53 | 12.45 | -51.83 | 0 | 6 | -1 | 77 | 501.006 | 7 | ↓ |
| Hi High (pH 8-9.5) | 6.55 | 13.2 | -36.95 | 1 | 6 | -1 | 81 | 501.006 | 7 | ↓ |
| Mid Mid (pH 6-8) | 6.55 | 12.87 | -48.48 | 1 | 6 | -1 | 81 | 501.006 | 7 | ↓ |
