In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
January 27th, 2011 | 20 | Yes |
Popular Name: N-(3-chloro-4-fluoro-phenyl)-2-(4-cyano-1-piperidyl)acetamide N-(3-chloro-4-fluoro-phenyl)-2-(…
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) | 2.84 | 7.66 | -61.2 | 2 | 4 | 1 | 57 | 296.753 | 3 | ↓ |
Hi High (pH 8-9.5) | 2.84 | 5.46 | -16.11 | 1 | 4 | 0 | 56 | 295.745 | 3 | ↓ |