| In ZINC since | Heavy atoms | Benign functionality |
|---|---|---|
| January 28th, 2011 | 15 | Yes |
Popular Name: 3-(3,5-dihydro-2H-1,4-benzoxazepin-4-yl)propanenitrile 3-(3,5-dihydro-2H-1,4-benzoxazep…
| 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) | 1.07 | 4.62 | -8.77 | 0 | 3 | 0 | 36 | 202.257 | 2 | ↓ |
| Lo Low (pH 4.5-6) | 1.07 | 6.71 | -50 | 1 | 3 | 1 | 37 | 203.265 | 2 | ↓ |
No pre-computed analogs available. Try a structural similarity search.
