| In ZINC since | Heavy atoms | Benign functionality |
|---|---|---|
| December 21st, 2009 | 20 | Yes |
Popular Name: 1-(3-bromo-4,5-dimethoxy-phenyl)-N-[[(2S)-1,4-dioxan-2-yl]methyl]methanamine 1-(3-bromo-4,5-dimethoxy-phenyl)…
| 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) | 1.71 | 4.51 | -50.51 | 2 | 5 | 1 | 54 | 347.229 | 6 | ↓ |
| Hi High (pH 8-9.5) | 1.71 | 3.15 | -7.44 | 1 | 5 | 0 | 49 | 346.221 | 6 | ↓ |
