| In ZINC since | Heavy atoms | Benign functionality |
|---|---|---|
| April 15th, 2011 | 19 | Yes |
Popular Name: (1R)-1-[3-bromo-4-(3-methoxyphenyl)sulfanyl-phenyl]ethanamine (1R)-1-[3-bromo-4-(3-methoxyphen…
| 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) | 2.54 | 7.22 | -49.41 | 3 | 2 | 1 | 37 | 339.278 | 4 | ↓ |
| Hi High (pH 8-9.5) | 2.54 | 6.92 | -5.04 | 2 | 2 | 0 | 35 | 338.27 | 4 | ↓ |
No pre-computed analogs available. Try a structural similarity search.
