| In ZINC since | Heavy atoms | Benign functionality |
|---|---|---|
| November 15th, 2010 | 21 | Yes |
Popular Name: (2S)-2-(4-bromophenyl)-3-(2-methoxy-5-methyl-phenyl)-3-oxo-propanenitrile (2S)-2-(4-bromophenyl)-3-(2-meth…
| 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) | 4.55 | 10.68 | -12.27 | 0 | 3 | 0 | 50 | 344.208 | 4 | ↓ |
No pre-computed analogs available. Try a structural similarity search.
