| In ZINC since | Heavy atoms | Benign functionality |
|---|---|---|
| November 7th, 2004 | 36 | No |
| 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) | 5.09 | 16.03 | -14.06 | 1 | 10 | 0 | 128 | 502.918 | 7 | ↓ |
| Hi High (pH 8-9.5) | 5.27 | 15.7 | -32.71 | 0 | 10 | -1 | 129 | 501.91 | 7 | ↓ |
| Hi High (pH 8-9.5) | 5.27 | 16.09 | -13.23 | 1 | 10 | 0 | 131 | 502.918 | 7 | ↓ |
