| In ZINC since | Heavy atoms | Benign functionality |
|---|---|---|
| November 18th, 2005 | 16 | No |
Popular Name: ethyl 3-(2-chlorophenyl)-2-nitriloprop-2-enoate ethyl 3-(2-chlorophenyl)-2-nitri…
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CAS Numbers: 14561-93-4 , 24393-43-9
| 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) | 3.08 | 3.55 | -5.78 | 0 | 3 | 0 | 50 | 235.67 | 4 | ↓ |
| Note Type | Comments | Provided By |
|---|---|---|
| mp | 87 | MolMall (formerly Molecular Diversity Preservation International) |
