| In ZINC since | Heavy atoms | Benign functionality |
|---|---|---|
| June 23rd, 2008 | 19 | Yes |
None
| 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) | 1.61 | 4.47 | -12.07 | 1 | 6 | 0 | 80 | 248.249 | 1 | ↓ |
| Hi High (pH 8-9.5) | 1.61 | 4.1 | -41.89 | 0 | 6 | -1 | 79 | 247.241 | 1 | ↓ |
No pre-computed analogs available. Try a structural similarity search.
