| In ZINC since | Heavy atoms | Benign functionality |
|---|---|---|
| February 3rd, 2009 | 25 | No |
Popular Name: (E)-2-cyano-N-[4-(cyanomethyl)phenyl]-3-(4-ethoxyphenyl)prop-2-enamide (E)-2-cyano-N-[4-(cyanomethyl)ph…
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| 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) | 3.59 | 9.19 | -14.95 | 1 | 5 | 0 | 86 | 331.375 | 6 | ↓ |
| Hi High (pH 8-9.5) | 3.77 | 7.54 | -47.78 | 0 | 5 | -1 | 92 | 330.367 | 6 | ↓ |
