| In ZINC since | Heavy atoms | Benign functionality |
|---|---|---|
| November 16th, 2008 | 17 | 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) | 3.46 | 9.2 | -39.06 | 2 | 1 | 1 | 17 | 244.383 | 3 | ↓ |
| Hi High (pH 8-9.5) | 3.46 | 7.89 | -3.05 | 1 | 1 | 0 | 12 | 243.375 | 3 | ↓ |
No pre-computed analogs available. Try a structural similarity search.
