In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
May 6th, 2010 | 19 | Yes |
Popular Name: (2S)-2-(2-bromo-4-fluoro-phenoxy)-2-(4-chlorophenyl)ethanamine (2S)-2-(2-bromo-4-fluoro-phenoxy…
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) | 3.96 | 7.32 | -55.37 | 3 | 2 | 1 | 37 | 345.619 | 4 | ↓ |
Hi High (pH 8-9.5) | 3.96 | 6.97 | -5.77 | 2 | 2 | 0 | 35 | 344.611 | 4 | ↓ |