| In ZINC since | Heavy atoms | Benign functionality |
|---|---|---|
| December 7th, 2010 | 17 | Yes |
Popular Name: (10S)-N-methyl-2,3,6,7,9,10-hexahydro-[1,4]dioxino[2,3-h][3]benzoxepin-10-amine (10S)-N-methyl-2,3,6,7,9,10-hexa…
| 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) | 1.14 | 4.18 | -37.61 | 2 | 4 | 1 | 44 | 236.291 | 1 | ↓ |
| Hi High (pH 8-9.5) | 1.14 | 3.49 | -5.43 | 1 | 4 | 0 | 40 | 235.283 | 1 | ↓ |
No pre-computed analogs available. Try a structural similarity search.
![2,3,6,7,9,10-hexahydro-[1,4]dioxino[2,3-h][3]benzoxepine](http://zinc12.docking.org/img/rings/151531.gif)