| In ZINC since | Heavy atoms | Benign functionality |
|---|---|---|
| May 22nd, 2011 | 21 | Yes |
Popular Name: 2-[5-(3,5-dihydro-2H-1,4-benzoxazepin-4-ylmethyl)-1,2,4-oxadiazol-3-yl]propan-2-amine 2-[5-(3,5-dihydro-2H-1,4-benzoxa…
| 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) | 1.30 | 0.96 | -44.71 | 3 | 6 | 1 | 79 | 289.359 | 3 | ↓ |
| Hi High (pH 8-9.5) | 1.30 | 0.71 | -8.97 | 2 | 6 | 0 | 77 | 288.351 | 3 | ↓ |
| Mid Mid (pH 6-8) | 1.30 | 3.06 | -105.54 | 4 | 6 | 2 | 80 | 290.367 | 3 | ↓ |
No pre-computed analogs available. Try a structural similarity search.
