| In ZINC since | Heavy atoms | Benign functionality |
|---|---|---|
| November 27th, 2010 | 19 | Yes |
Popular Name: (1R,2S,4S)-4-ethyl-2-[[methyl-[[(2S)-tetrahydropyran-2-yl]methyl]amino]methyl]cyclohexanol (1R,2S,4S)-4-ethyl-2-[[methyl-[[…
| 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) | 3.05 | 6.45 | -35.85 | 2 | 3 | 1 | 34 | 270.437 | 5 | ↓ |
| Hi High (pH 8-9.5) | 3.05 | 4.32 | -3.62 | 1 | 3 | 0 | 33 | 269.429 | 5 | ↓ |
No pre-computed analogs available. Try a structural similarity search.
