| In ZINC since | Heavy atoms | Benign functionality |
|---|---|---|
| November 27th, 2010 | 19 | Yes |
Popular Name: (1S,2S,4S)-4-ethyl-2-[[methyl-[(1S)-1-(2-thienyl)ethyl]amino]methyl]cyclohexanol (1S,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) | 4.03 | 8.39 | -29.15 | 2 | 2 | 1 | 25 | 282.473 | 5 | ↓ |
| Mid Mid (pH 6-8) | 4.03 | 6.89 | -2.37 | 1 | 2 | 0 | 23 | 281.465 | 5 | ↓ |
No pre-computed analogs available. Try a structural similarity search.
