| In ZINC since | Heavy atoms | Benign functionality |
|---|---|---|
| October 11th, 2009 | 18 | Yes |
Popular Name: (1R,2R,4S)-4-ethyl-2-[methyl(3-thienylmethyl)amino]cyclohexanecarbonitrile (1R,2R,4S)-4-ethyl-2-[methyl(3-t…
| 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) | 3.58 | 9.8 | -48.56 | 1 | 2 | 1 | 28 | 263.43 | 4 | ↓ |
| Mid Mid (pH 6-8) | 3.58 | 8.3 | -5.71 | 0 | 2 | 0 | 27 | 262.422 | 4 | ↓ |
