| In ZINC since | Heavy atoms | Benign functionality |
|---|---|---|
| April 22nd, 2006 | 29 | 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) | 1.72 | 1.05 | -17.16 | 4 | 8 | 0 | 119 | 395.415 | 6 | ↓ |
| Ref Reference (pH 7) | 1.72 | 1.37 | -16.46 | 4 | 8 | 0 | 119 | 395.415 | 6 | ↓ |
| Hi High (pH 8-9.5) | 1.70 | 1.61 | -49.45 | 2 | 8 | -1 | 118 | 394.407 | 6 | ↓ |
| Hi High (pH 8-9.5) | 1.70 | 1.31 | -62.69 | 2 | 8 | -1 | 118 | 394.407 | 6 | ↓ |
| Hi High (pH 8-9.5) | 1.72 | 2.15 | -43.97 | 3 | 8 | -1 | 122 | 394.407 | 6 | ↓ |
| Mid Mid (pH 6-8) | 1.72 | 1.81 | -55.91 | 3 | 8 | -1 | 122 | 394.407 | 6 | ↓ |
