In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
November 27th, 2010 | 18 | Yes |
Popular Name: (1S,2S,4S)-2-[[cyclopropyl(2,2,2-trifluoroethyl)amino]methyl]-4-methyl-cyclohexanol (1S,2S,4S)-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) | 2.78 | 4.57 | -4.17 | 1 | 2 | 0 | 23 | 265.319 | 5 | ↓ |
Mid Mid (pH 6-8) | 2.78 | 6.37 | -35.49 | 2 | 2 | 1 | 25 | 266.327 | 5 | ↓ |
No pre-computed analogs available. Try a structural similarity search.