| In ZINC since | Heavy atoms | Benign functionality |
|---|---|---|
| October 23rd, 2009 | 25 | Yes |
Popular Name: N-[(2S)-2-(3-chlorophenyl)-2-(dimethylamino)ethyl]-1-methylsulfonyl-piperidine-4-carboxamide N-[(2S)-2-(3-chlorophenyl)-2-(di…
| 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) | 1.86 | 5.72 | -54.1 | 2 | 6 | 1 | 71 | 388.941 | 6 | ↓ |
| Hi High (pH 8-9.5) | 1.86 | 3.28 | -17.04 | 1 | 6 | 0 | 70 | 387.933 | 6 | ↓ |
No pre-computed analogs available. Try a structural similarity search.
