| In ZINC since | Heavy atoms | Benign functionality |
|---|---|---|
| August 8th, 2007 | 33 | 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) | 3.54 | 5.43 | -15.16 | 3 | 8 | 0 | 108 | 471.941 | 8 | ↓ |
| Hi High (pH 8-9.5) | 3.52 | 5.52 | -57.39 | 1 | 8 | -1 | 107 | 470.933 | 8 | ↓ |
| Hi High (pH 8-9.5) | 3.52 | 5.92 | -51.59 | 1 | 8 | -1 | 107 | 470.933 | 8 | ↓ |
| Hi High (pH 8-9.5) | 3.54 | 6.2 | -45.16 | 2 | 8 | -1 | 111 | 470.933 | 8 | ↓ |
| Mid Mid (pH 6-8) | 3.54 | 6.29 | -53.54 | 2 | 8 | -1 | 111 | 470.933 | 8 | ↓ |
