| In ZINC since | Heavy atoms | Benign functionality |
|---|---|---|
| August 8th, 2007 | 32 | 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) | 3.13 | 3.39 | -15.61 | 4 | 8 | 0 | 119 | 457.914 | 7 | ↓ |
| Ref Reference (pH 7) | 3.13 | 3.06 | -14.28 | 4 | 8 | 0 | 119 | 457.914 | 7 | ↓ |
| Hi High (pH 8-9.5) | 3.11 | 3.64 | -45.27 | 2 | 8 | -1 | 118 | 456.906 | 7 | ↓ |
| Hi High (pH 8-9.5) | 3.11 | 3.32 | -55.77 | 2 | 8 | -1 | 118 | 456.906 | 7 | ↓ |
| Hi High (pH 8-9.5) | 3.13 | 4.16 | -41.34 | 3 | 8 | -1 | 122 | 456.906 | 7 | ↓ |
| Mid Mid (pH 6-8) | 3.13 | 3.83 | -50.09 | 3 | 8 | -1 | 122 | 456.906 | 7 | ↓ |
