| In ZINC since | Heavy atoms | Benign functionality |
|---|---|---|
| November 9th, 2011 | 21 | Yes |
Popular Name: [(2R,3S)-3-(5-bromo-2,3-dihydro-1,4-benzodioxin-7-yl)-4-ethyl-morpholin-2-yl]methanamine [(2R,3S)-3-(5-bromo-2,3-dihydro-…
| 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) | 1.38 | 2.45 | -43.15 | 3 | 5 | 1 | 59 | 358.256 | 3 | ↓ |
| Hi High (pH 8-9.5) | 1.38 | 2.08 | -5.17 | 2 | 5 | 0 | 57 | 357.248 | 3 | ↓ |
| Lo Low (pH 4.5-6) | 1.38 | 4.08 | -109.26 | 4 | 5 | 2 | 60 | 359.264 | 3 | ↓ |
No pre-computed analogs available. Try a structural similarity search.
