| In ZINC since | Heavy atoms | Benign functionality |
|---|---|---|
| April 23rd, 2011 | 19 | Yes |
Popular Name: (2S)-N-[(1R)-2-(4-fluorophenyl)-1-methyl-ethyl]piperidine-2-carboxamide (2S)-N-[(1R)-2-(4-fluorophenyl)-…
| 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) | 2.40 | 6.55 | -39.15 | 3 | 3 | 1 | 46 | 265.352 | 4 | ↓ |
| Mid Mid (pH 6-8) | 2.40 | 5.24 | -10.3 | 2 | 3 | 0 | 41 | 264.344 | 4 | ↓ |
No pre-computed analogs available. Try a structural similarity search.
