| In ZINC since | Heavy atoms | Benign functionality |
|---|---|---|
| August 15th, 2007 | 37 | 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) | 5.67 | 11.24 | -14.29 | 2 | 7 | 0 | 88 | 518.013 | 7 | ↓ |
| Hi High (pH 8-9.5) | 5.65 | 11.82 | -43.85 | 0 | 7 | -1 | 87 | 517.005 | 7 | ↓ |
| Hi High (pH 8-9.5) | 5.65 | 11.58 | -53.17 | 0 | 7 | -1 | 87 | 517.005 | 7 | ↓ |
| Hi High (pH 8-9.5) | 5.67 | 12.33 | -38.56 | 1 | 7 | -1 | 91 | 517.005 | 7 | ↓ |
| Mid Mid (pH 6-8) | 5.67 | 12.01 | -50.39 | 1 | 7 | -1 | 91 | 517.005 | 7 | ↓ |
