In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
October 23rd, 2009 | 20 | Yes |
Popular Name: 2-[[(1R)-1-[(3S)-1-ethyl-3-piperidyl]ethyl]amino]-6-fluoro-benzonitrile 2-[[(1R)-1-[(3S)-1-ethyl-3-piper…
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) | 3.79 | 8.77 | -43.69 | 2 | 3 | 1 | 40 | 276.379 | 4 | ↓ |
No pre-computed analogs available. Try a structural similarity search.