| 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) | 5.13 | 8.34 | -14.73 | 3 | 7 | 0 | 99 | 489.959 | 6 | ↓ |
| Ref Reference (pH 7) | 5.13 | 7.69 | -12.36 | 3 | 7 | 0 | 99 | 489.959 | 6 | ↓ |
| Hi High (pH 8-9.5) | 5.11 | 8.09 | -50.13 | 1 | 7 | -1 | 98 | 488.951 | 6 | ↓ |
| Hi High (pH 8-9.5) | 5.11 | 8 | -48.9 | 1 | 7 | -1 | 98 | 488.951 | 6 | ↓ |
| Hi High (pH 8-9.5) | 5.13 | 8.53 | -34.88 | 2 | 7 | -1 | 102 | 488.951 | 6 | ↓ |
| Mid Mid (pH 6-8) | 5.13 | 8.46 | -46.95 | 2 | 7 | -1 | 102 | 488.951 | 6 | ↓ |
