| In ZINC since | Heavy atoms | Benign functionality |
|---|---|---|
| November 27th, 2010 | 20 | Yes |
Popular Name: (1R,2S,4R)-2-[[methyl-[(1S)-1-(2-thienyl)ethyl]amino]methyl]-4-propyl-cyclohexanol (1R,2S,4R)-2-[[methyl-[(1S)-1-(2…
| 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) | 4.59 | 8.83 | -31.31 | 2 | 2 | 1 | 25 | 296.5 | 6 | ↓ |
| Mid Mid (pH 6-8) | 4.59 | 6.57 | -3.1 | 1 | 2 | 0 | 23 | 295.492 | 6 | ↓ |
No pre-computed analogs available. Try a structural similarity search.
