In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
November 27th, 2010 | 19 | Yes |
Popular Name: (1R,2S,4R)-2-[[cyclopropyl(2,2,2-trifluoroethyl)amino]methyl]-4-ethyl-cyclohexanol (1R,2S,4R)-2-[[cyclopropyl(2,2,2…
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) | 3.46 | 6.75 | -2.1 | 1 | 2 | 0 | 23 | 279.346 | 6 | ↓ |
Mid Mid (pH 6-8) | 3.46 | 7.8 | -31.02 | 2 | 2 | 1 | 25 | 280.354 | 6 | ↓ |
No pre-computed analogs available. Try a structural similarity search.