| In ZINC since | Heavy atoms | Benign functionality |
|---|---|---|
| October 18th, 2011 | 20 | Yes |
Popular Name: (2S)-2-cyclopropyl-3-(3,5-dihydro-2H-1,4-benzoxazepin-4-yl)-2-(methylamino)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) | 2.11 | 7.2 | -41.22 | 2 | 4 | 1 | 49 | 272.372 | 4 | ↓ |
| Mid Mid (pH 6-8) | 2.11 | 4.79 | -9.5 | 1 | 4 | 0 | 48 | 271.364 | 4 | ↓ |
No pre-computed analogs available. Try a structural similarity search.
