| In ZINC since | Heavy atoms | Benign functionality |
|---|---|---|
| May 15th, 2011 | 17 | Yes |
Popular Name: 1-(4-ethyl-4-piperidyl)-N-[[(2S)-tetrahydropyran-2-yl]methyl]methanamine 1-(4-ethyl-4-piperidyl)-N-[[(2S)…
| 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) | 1.41 | 5.18 | -97.96 | 4 | 3 | 2 | 42 | 242.407 | 5 | ↓ |
| Hi High (pH 8-9.5) | 1.41 | 4.01 | -39.61 | 3 | 3 | 1 | 38 | 241.399 | 5 | ↓ |
No pre-computed analogs available. Try a structural similarity search.
