| In ZINC since | Heavy atoms | Benign functionality |
|---|---|---|
| October 18th, 2011 | 21 | Yes |
Popular Name: (2S)-2-cyclopropyl-3-(3,5-dihydro-2H-1,4-benzoxazepin-4-yl)-2-(ethylamino)propanenitrile (2S)-2-cyclopropyl-3-(3,5-dihydr…
| 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) | 2.48 | 7.69 | -42.73 | 2 | 4 | 1 | 49 | 286.399 | 5 | ↓ |
| Mid Mid (pH 6-8) | 2.48 | 6.05 | -9.77 | 1 | 4 | 0 | 48 | 285.391 | 5 | ↓ |
No pre-computed analogs available. Try a structural similarity search.
