| In ZINC since | Heavy atoms | Benign functionality |
|---|---|---|
| July 20th, 2009 | 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) | 5.42 | 13.47 | -68.52 | 1 | 6 | 0 | 78 | 503.668 | 8 | ↓ |
| Hi High (pH 8-9.5) | 5.42 | 11.11 | -58.18 | 0 | 6 | -1 | 77 | 502.66 | 8 | ↓ |
| Lo Low (pH 4.5-6) | 5.42 | 12.82 | -48.99 | 2 | 6 | 1 | 75 | 504.676 | 8 | ↓ |
