| In ZINC since | Heavy atoms | Benign functionality |
|---|---|---|
| May 16th, 2011 | 20 | No |
Popular Name: (3S)-3-[2-(4-nitrophenyl)ethyl]piperidine-3-carboxylic (3S)-3-[2-(4-nitrophenyl)ethyl]p…
| 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) | 1.75 | 8.44 | -56.77 | 2 | 6 | 0 | 103 | 278.308 | 5 | ↓ |
| Hi High (pH 8-9.5) | 1.75 | 7.06 | -43.81 | 1 | 6 | -1 | 98 | 277.3 | 5 | ↓ |
No pre-computed analogs available. Try a structural similarity search.
