| In ZINC since | Heavy atoms | Benign functionality |
|---|---|---|
| November 28th, 2005 | 27 | 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) | 3.06 | 10.12 | -20.25 | 1 | 7 | 0 | 78 | 386.477 | 5 | ↓ |
| Hi High (pH 8-9.5) | 3.40 | 10.8 | -49.82 | 0 | 7 | -1 | 80 | 385.469 | 5 | ↓ |
| Hi High (pH 8-9.5) | 3.24 | 9.54 | -47.86 | 0 | 7 | -1 | 80 | 385.469 | 5 | ↓ |
