| In ZINC since | Heavy atoms | Benign functionality |
|---|---|---|
| February 13th, 2009 | 40 | 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) | 6.68 | 15.68 | -92.76 | 3 | 6 | 2 | 65 | 558.744 | 11 | ↓ |
| Hi High (pH 8-9.5) | 6.68 | 13.12 | -46.78 | 2 | 6 | 1 | 63 | 557.736 | 11 | ↓ |
| Hi High (pH 8-9.5) | 6.68 | 13.13 | -48.47 | 2 | 6 | 1 | 63 | 557.736 | 11 | ↓ |
