| In ZINC since | Heavy atoms | Benign functionality |
|---|---|---|
| August 8th, 2007 | 34 | 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) | 4.11 | 6.55 | -18.4 | 3 | 8 | 0 | 108 | 485.968 | 8 | ↓ |
| Ref Reference (pH 7) | 4.11 | 6.32 | -13.37 | 3 | 8 | 0 | 108 | 485.968 | 8 | ↓ |
| Hi High (pH 8-9.5) | 4.09 | 6.06 | -56.9 | 1 | 8 | -1 | 107 | 484.96 | 8 | ↓ |
| Hi High (pH 8-9.5) | 4.09 | 6.33 | -48.79 | 1 | 8 | -1 | 107 | 484.96 | 8 | ↓ |
| Hi High (pH 8-9.5) | 4.11 | 7.32 | -43.59 | 2 | 8 | -1 | 111 | 484.96 | 8 | ↓ |
| Mid Mid (pH 6-8) | 4.11 | 7.08 | -49.12 | 2 | 8 | -1 | 111 | 484.96 | 8 | ↓ |
