| In ZINC since | Heavy atoms | Benign functionality |
|---|---|---|
| February 5th, 2011 | 23 | Yes |
Popular Name: (3S)-N-[[3-(dimethylamino)phenyl]methyl]-1-methylsulfonyl-piperidine-3-carboxamide (3S)-N-[[3-(dimethylamino)phenyl…
| 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) | 1.07 | 3.7 | -13.78 | 1 | 6 | 0 | 70 | 339.461 | 5 | ↓ |
| Lo Low (pH 4.5-6) | 1.07 | 4.46 | -100.38 | 2 | 6 | 0 | 71 | 340.469 | 5 | ↓ |
No pre-computed analogs available. Try a structural similarity search.
