In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
September 5th, 2011 | 24 | Yes |
Popular Name: 1-[2-oxo-2-[(3S)-3-propoxy-1-piperidyl]ethyl]-3-(trifluoromethyl)pyridin-2-one 1-[2-oxo-2-[(3S)-3-propoxy-1-pip…
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) | 1.78 | 7.78 | -22.55 | 0 | 5 | 0 | 52 | 346.349 | 6 | ↓ |
No pre-computed analogs available. Try a structural similarity search.