| In ZINC since | Heavy atoms | Benign functionality |
|---|---|---|
| August 15th, 2007 | 35 | 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) | 5.80 | 11.27 | -14.69 | 2 | 6 | 0 | 78 | 491.95 | 6 | ↓ |
| Ref Reference (pH 7) | 5.80 | 10.61 | -12.51 | 2 | 6 | 0 | 78 | 491.95 | 6 | ↓ |
| Hi High (pH 8-9.5) | 5.78 | 11.4 | -39.93 | 0 | 6 | -1 | 77 | 490.942 | 6 | ↓ |
| Hi High (pH 8-9.5) | 5.78 | 10.93 | -51.65 | 0 | 6 | -1 | 77 | 490.942 | 6 | ↓ |
| Hi High (pH 8-9.5) | 5.80 | 11.45 | -34.76 | 1 | 6 | -1 | 81 | 490.942 | 6 | ↓ |
| Mid Mid (pH 6-8) | 5.80 | 11.38 | -47.6 | 1 | 6 | -1 | 81 | 490.942 | 6 | ↓ |
