| In ZINC since | Heavy atoms | Benign functionality |
|---|---|---|
| March 5th, 2009 | 45 | 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) | 8.75 | 16.49 | -144.67 | 5 | 7 | 3 | 75 | 645.655 | 13 | ↓ |
| Hi High (pH 8-9.5) | 8.75 | 16.1 | -93.45 | 4 | 7 | 2 | 74 | 644.647 | 13 | ↓ |
| Hi High (pH 8-9.5) | 8.75 | 15.72 | -53.49 | 3 | 7 | 1 | 73 | 643.639 | 13 | ↓ |
