In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
September 21st, 2010 | 20 | Yes |
Popular Name: 2-[[(1R)-2-[(3S,5S)-3,5-dimethyl-1-piperidyl]-1-methyl-ethyl]amino]pyridine-3-carbonitrile 2-[[(1R)-2-[(3S,5S)-3,5-dimethyl…
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) | 2.59 | 9.38 | -34.99 | 2 | 4 | 1 | 53 | 273.404 | 4 | ↓ |
No pre-computed analogs available. Try a structural similarity search.