| In ZINC since | Heavy atoms | Benign functionality |
|---|---|---|
| March 15th, 2010 | 35 | 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) | 3.43 | 6.6 | -16.78 | 2 | 9 | 0 | 106 | 481.549 | 9 | ↓ |
| Hi High (pH 8-9.5) | 3.20 | 6.63 | -64.87 | 0 | 9 | -1 | 105 | 480.541 | 9 | ↓ |
| Hi High (pH 8-9.5) | 3.20 | 6.87 | -51.15 | 0 | 9 | -1 | 105 | 480.541 | 9 | ↓ |
| Hi High (pH 8-9.5) | 3.43 | 7.91 | -45.6 | 1 | 9 | -1 | 109 | 480.541 | 9 | ↓ |
