| In ZINC since | Heavy atoms | Benign functionality |
|---|---|---|
| April 15th, 2011 | 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) | 2.35 | 6.47 | -48.47 | 2 | 5 | 1 | 66 | 236.295 | 2 | ↓ |
| Hi High (pH 8-9.5) | 2.35 | 5.22 | -7.34 | 1 | 5 | 0 | 61 | 235.287 | 2 | ↓ |
No pre-computed analogs available. Try a structural similarity search.
