| In ZINC since | Heavy atoms | Benign functionality |
|---|---|---|
| September 8th, 2008 | 36 | No |
None
| 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) | 3.07 | 9.25 | -17.75 | 1 | 8 | 0 | 98 | 488.54 | 10 | ↓ |
| Mid Mid (pH 6-8) | 2.49 | 9.9 | -25.68 | 0 | 8 | 0 | 95 | 488.54 | 10 | ↓ |
| Lo Low (pH 4.5-6) | 3.52 | 9.21 | -64.11 | 2 | 8 | 1 | 99 | 489.548 | 9 | ↓ |
| Lo Low (pH 4.5-6) | 2.49 | 10.18 | -67.68 | 1 | 8 | 1 | 96 | 489.548 | 10 | ↓ |
