| In ZINC since | Heavy atoms | Benign functionality |
|---|---|---|
| December 11th, 2011 | 16 | Yes |
Popular Name: 4-(2-chloro-6-fluoro-phenyl)piperidine-4-carbonitrile 4-(2-chloro-6-fluoro-phenyl)pipe…
| 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) | 2.35 | 5.79 | -43.95 | 2 | 2 | 1 | 40 | 239.701 | 1 | ↓ |
| Hi High (pH 8-9.5) | 2.35 | 4.42 | -6.72 | 1 | 2 | 0 | 36 | 238.693 | 1 | ↓ |
No pre-computed analogs available. Try a structural similarity search.
