| In ZINC since | Heavy atoms | Benign functionality |
|---|---|---|
| April 4th, 2006 | 26 | No |
Popular Name: N-(5-chloro-2-methyl-phenyl)-2-cyano-3-(4-diethylaminophenyl)-prop-2-enamide N-(5-chloro-2-methyl-phenyl)-2-c…
| 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) | 5.10 | 11.69 | -8.12 | 1 | 4 | 0 | 56 | 367.88 | 6 | ↓ |
| Hi High (pH 8-9.5) | 5.28 | 10.35 | -40.79 | 0 | 4 | -1 | 62 | 366.872 | 6 | ↓ |
| Mid Mid (pH 6-8) | 5.10 | 11.83 | -29.6 | 2 | 4 | 0 | 57 | 368.888 | 6 | ↓ |
