| In ZINC since | Heavy atoms | Benign functionality |
|---|---|---|
| August 3rd, 2010 | 21 | Yes |
Popular Name: 1-(3-bromo-4-methoxy-phenyl)-2-[2-dimethylaminoethyl(propyl)amino]ethanone 1-(3-bromo-4-methoxy-phenyl)-2-[…
| 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) | 3.19 | 7.78 | -38.68 | 1 | 4 | 1 | 34 | 358.3 | 9 | ↓ |
| Hi High (pH 8-9.5) | 3.19 | 5.3 | -9.69 | 0 | 4 | 0 | 33 | 357.292 | 9 | ↓ |
| Hi High (pH 8-9.5) | 3.19 | 7.32 | -45.77 | 1 | 4 | 1 | 34 | 358.3 | 9 | ↓ |
| Lo Low (pH 4.5-6) | 3.19 | 9.8 | -115.87 | 2 | 4 | 2 | 35 | 359.308 | 9 | ↓ |
