| In ZINC since | Heavy atoms | Benign functionality |
|---|---|---|
| March 15th, 2010 | 33 | 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) | 5.51 | 11.26 | -17.13 | 2 | 5 | 0 | 69 | 441.506 | 4 | ↓ |
| Hi High (pH 8-9.5) | 5.28 | 11.34 | -56.67 | 0 | 5 | -1 | 68 | 440.498 | 4 | ↓ |
| Hi High (pH 8-9.5) | 5.28 | 11.91 | -50.23 | 0 | 5 | -1 | 68 | 440.498 | 4 | ↓ |
| Hi High (pH 8-9.5) | 5.51 | 12.79 | -38.79 | 1 | 5 | -1 | 72 | 440.498 | 4 | ↓ |
