| In ZINC since | Heavy atoms | Benign functionality |
|---|---|---|
| September 21st, 2010 | 20 | 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) | 3.49 | 5.5 | -11.3 | 2 | 4 | 0 | 59 | 271.316 | 5 | ↓ |
| Hi High (pH 8-9.5) | 3.49 | 6.5 | -54.87 | 1 | 4 | -1 | 61 | 270.308 | 5 | ↓ |
No pre-computed analogs available. Try a structural similarity search.
