| In ZINC since | Heavy atoms | Benign functionality |
|---|---|---|
| April 12th, 2010 | 24 | 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) | 0.66 | 5.17 | -38.49 | 6 | 8 | 1 | 131 | 327.368 | 4 | ↓ |
| Hi High (pH 8-9.5) | 0.66 | 5.23 | -16.65 | 5 | 8 | 0 | 129 | 326.36 | 4 | ↓ |
| Lo Low (pH 4.5-6) | 0.66 | 5.63 | -74.24 | 7 | 8 | 2 | 132 | 328.376 | 4 | ↓ |
