| In ZINC since | Heavy atoms | Benign functionality |
|---|---|---|
| October 15th, 2011 | 16 | Yes |
Popular Name: (2S)-2-cyclopropyl-2-(methylamino)-3-(1,4-oxazepan-4-yl)propanenitrile (2S)-2-cyclopropyl-2-(methylamin…
| 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) | 0.96 | 4.61 | -38.16 | 2 | 4 | 1 | 49 | 224.328 | 4 | ↓ |
| Mid Mid (pH 6-8) | 0.96 | 2.33 | -4.79 | 1 | 4 | 0 | 48 | 223.32 | 4 | ↓ |
No pre-computed analogs available. Try a structural similarity search.
