| In ZINC since | Heavy atoms | Benign functionality |
|---|---|---|
| October 30th, 2011 | 16 | Yes |
Popular Name: [(2R,3S)-2-(3-fluorophenyl)-1-methyl-3-piperidyl]methanamine [(2R,3S)-2-(3-fluorophenyl)-1-me…
| 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) | 1.64 | 4.04 | -43.86 | 3 | 2 | 1 | 31 | 223.315 | 2 | ↓ |
| Mid Mid (pH 6-8) | 1.64 | 6.07 | -105.6 | 4 | 2 | 2 | 32 | 224.323 | 2 | ↓ |
No pre-computed analogs available. Try a structural similarity search.
