| 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) | 6.04 | 11.22 | -13.76 | 2 | 7 | 0 | 88 | 518.013 | 8 | ↓ |
| Ref Reference (pH 7) | 6.04 | 10.89 | -12 | 2 | 7 | 0 | 88 | 518.013 | 8 | ↓ |
| Hi High (pH 8-9.5) | 6.02 | 11.47 | -42.96 | 0 | 7 | -1 | 87 | 517.005 | 8 | ↓ |
| Hi High (pH 8-9.5) | 6.02 | 11.24 | -51.85 | 0 | 7 | -1 | 87 | 517.005 | 8 | ↓ |
| Hi High (pH 8-9.5) | 6.04 | 11.98 | -38.63 | 1 | 7 | -1 | 91 | 517.005 | 8 | ↓ |
| Mid Mid (pH 6-8) | 6.04 | 11.66 | -48.64 | 1 | 7 | -1 | 91 | 517.005 | 8 | ↓ |
