| In ZINC since | Heavy atoms | Benign functionality |
|---|---|---|
| April 29th, 2011 | 27 | Yes |
Popular Name: (2S)-2-(4-chlorophenyl)-1-[(3R)-3-(ethoxymethyl)-1-piperidyl]-3-(4-pyridyl)propan-1-one (2S)-2-(4-chlorophenyl)-1-[(3R)-…
| 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) | 4.06 | 10.82 | -11.15 | 0 | 4 | 0 | 42 | 386.923 | 7 | ↓ |
| Lo Low (pH 4.5-6) | 4.06 | 11.05 | -40 | 1 | 4 | 1 | 44 | 387.931 | 7 | ↓ |
No pre-computed analogs available. Try a structural similarity search.
