| In ZINC since | Heavy atoms | Benign functionality |
|---|---|---|
| November 1st, 2011 | 13 | 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) | 2.29 | 5.91 | -27.38 | 3 | 2 | 1 | 40 | 177.271 | 1 | ↓ |
| Hi High (pH 8-9.5) | 2.29 | 5.44 | -3.87 | 2 | 2 | 0 | 39 | 176.263 | 1 | ↓ |
No pre-computed analogs available. Try a structural similarity search.
