| In ZINC since | Heavy atoms | Benign functionality |
|---|---|---|
| May 22nd, 2011 | 20 | Yes |
Popular Name: 2-(3,5-dihydro-2H-1,4-benzoxazepin-4-yl)-N-[[(2R)-tetrahydrofuran-2-yl]methyl]ethanamine 2-(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) | 1.42 | 5.31 | -35.25 | 2 | 4 | 1 | 35 | 277.388 | 5 | ↓ |
| Hi High (pH 8-9.5) | 1.42 | 3.24 | -4.89 | 1 | 4 | 0 | 34 | 276.38 | 5 | ↓ |
| Mid Mid (pH 6-8) | 1.42 | 4.58 | -41.92 | 2 | 4 | 1 | 38 | 277.388 | 5 | ↓ |
No pre-computed analogs available. Try a structural similarity search.
