In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
October 23rd, 2009 | 19 | Yes |
Popular Name: 2-fluoro-6-[[(1S)-1-[(3R)-1-methyl-3-piperidyl]ethyl]amino]benzonitrile 2-fluoro-6-[[(1S)-1-[(3R)-1-meth…
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) | 3.42 | 8.13 | -44.52 | 2 | 3 | 1 | 40 | 262.352 | 3 | ↓ |
No pre-computed analogs available. Try a structural similarity search.