| In ZINC since | Heavy atoms | Benign functionality |
|---|---|---|
| November 24th, 2009 | 20 | Yes |
Popular Name: (2S)-2-(cyclopropylamino)-2-[(2R)-5-ethoxy-2-methyl-2,3-dihydrobenzofuran-6-yl]acetonitrile (2S)-2-(cyclopropylamino)-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) | 2.58 | 6.26 | -6.86 | 1 | 4 | 0 | 54 | 272.348 | 5 | ↓ |
| Mid Mid (pH 6-8) | 2.58 | 7.18 | -39.79 | 2 | 4 | 1 | 59 | 273.356 | 5 | ↓ |
No pre-computed analogs available. Try a structural similarity search.
