| In ZINC since | Heavy atoms | Benign functionality |
|---|---|---|
| November 15th, 2010 | 20 | Yes |
Popular Name: (2S)-2-(4-propoxyphenyl)-2-[[(2R)-tetrahydrofuran-2-yl]methylamino]acetonitrile (2S)-2-(4-propoxyphenyl)-2-[[(2R…
| 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) | 2.77 | 5.84 | -8.37 | 1 | 4 | 0 | 54 | 274.364 | 7 | ↓ |
| Lo Low (pH 4.5-6) | 2.77 | 6.92 | -48.13 | 2 | 4 | 1 | 59 | 275.372 | 7 | ↓ |
No pre-computed analogs available. Try a structural similarity search.
