| In ZINC since | Heavy atoms | Benign functionality |
|---|---|---|
| September 12th, 2012 | 44 | 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) | 3.93 | 3.91 | -58.66 | 5 | 13 | -1 | 203 | 611.624 | 9 | ↓ |
| Lo Low (pH 4.5-6) | 3.93 | 3.54 | -28.67 | 6 | 13 | 0 | 200 | 612.632 | 9 | ↓ |
| Note Type | Comments | Provided By |
|---|---|---|
| Notes | Assay min. 95% | Apollo Scientific Bioactives |
No pre-computed analogs available. Try a structural similarity search.