| In ZINC since | Heavy atoms | Benign functionality |
|---|---|---|
| November 15th, 2010 | 17 | 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) | 1.68 | 4.53 | -51.97 | 3 | 5 | 1 | 83 | 237.279 | 4 | ↓ |
| Hi High (pH 8-9.5) | 1.68 | 3.35 | -9.39 | 2 | 5 | 0 | 78 | 236.271 | 4 | ↓ |
No pre-computed analogs available. Try a structural similarity search.
