In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
December 6th, 2011 | 20 | Yes |
Popular Name: 2-[(2R,3S)-2,3-dimethyl-1-piperidyl]quinoline-3-carbonitrile 2-[(2R,3S)-2,3-dimethyl-1-piperi…
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) | 3.55 | 9.46 | -6.65 | 0 | 3 | 0 | 40 | 265.36 | 1 | ↓ |
No pre-computed analogs available. Try a structural similarity search.