In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
April 25th, 2009 | 18 | Yes |
Popular Name: (2S)-2-(4-bromophenyl)-2-(2-fluorophenoxy)ethanamine (2S)-2-(4-bromophenyl)-2-(2-fluo…
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) | 3.31 | 6.71 | -53.26 | 3 | 2 | 1 | 37 | 311.174 | 4 | ↓ |
Hi High (pH 8-9.5) | 3.31 | 6.41 | -5.24 | 2 | 2 | 0 | 35 | 310.166 | 4 | ↓ |