| In ZINC since | Heavy atoms | Benign functionality |
|---|---|---|
| November 15th, 2010 | 19 | Yes |
Popular Name: 2-chloro-6-[[(2R)-2-(1-piperidyl)propyl]amino]benzonitrile 2-chloro-6-[[(2R)-2-(1-piperidyl…
| 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) | 3.40 | 8.68 | -38.59 | 2 | 3 | 1 | 40 | 278.807 | 4 | ↓ |
| Hi High (pH 8-9.5) | 3.40 | 6.61 | -6.8 | 1 | 3 | 0 | 39 | 277.799 | 4 | ↓ |
No pre-computed analogs available. Try a structural similarity search.
