| In ZINC since | Heavy atoms | Benign functionality |
|---|---|---|
| May 22nd, 2011 | 19 | Yes |
Popular Name: (1S,2S)-2-(3,5-dihydro-2H-1,4-benzoxazepin-4-yl)cyclohexanecarbonitrile (1S,2S)-2-(3,5-dihydro-2H-1,4-be…
| 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) | 3.17 | 6.91 | -8.19 | 0 | 3 | 0 | 36 | 256.349 | 1 | ↓ |
| Mid Mid (pH 6-8) | 3.17 | 8.59 | -39.7 | 1 | 3 | 1 | 37 | 257.357 | 1 | ↓ |
No pre-computed analogs available. Try a structural similarity search.
