| In ZINC since | Heavy atoms | Benign functionality |
|---|---|---|
| August 15th, 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) | 5.12 | 7.62 | -15.82 | 3 | 6 | 0 | 89 | 453.97 | 6 | ↓ |
| Ref Reference (pH 7) | 5.12 | 7.57 | -11.36 | 3 | 6 | 0 | 89 | 453.97 | 6 | ↓ |
| Hi High (pH 8-9.5) | 5.10 | 7.41 | -54.06 | 1 | 6 | -1 | 88 | 452.962 | 6 | ↓ |
| Hi High (pH 8-9.5) | 5.10 | 7.38 | -48.95 | 1 | 6 | -1 | 88 | 452.962 | 6 | ↓ |
| Hi High (pH 8-9.5) | 5.12 | 8.38 | -44.1 | 2 | 6 | -1 | 92 | 452.962 | 6 | ↓ |
| Mid Mid (pH 6-8) | 5.12 | 8.34 | -49.15 | 2 | 6 | -1 | 92 | 452.962 | 6 | ↓ |
