In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
November 17th, 2009 | 21 | Yes |
Popular Name: (2S)-3-(3-bromophenyl)-2-(4-ethoxyphenyl)-3-oxo-propanenitrile (2S)-3-(3-bromophenyl)-2-(4-etho…
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) | 4.53 | 9.74 | -13.11 | 0 | 3 | 0 | 50 | 344.208 | 5 | ↓ |