| In ZINC since | Heavy atoms | Benign functionality |
|---|---|---|
| July 10th, 2009 | 36 | 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) | 4.69 | 14.91 | -56.59 | 1 | 7 | 0 | 82 | 488.632 | 9 | ↓ |
| Hi High (pH 8-9.5) | 4.69 | 12.7 | -48.6 | 0 | 7 | -1 | 81 | 487.624 | 9 | ↓ |
| Lo Low (pH 4.5-6) | 4.69 | 13.77 | -51.88 | 2 | 7 | 1 | 79 | 489.64 | 9 | ↓ |
