In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
May 13th, 2010 | 19 | Yes |
Popular Name: (1S)-2-(3-bromo-4-fluoro-phenyl)-1-(3,5-difluorophenyl)ethanamine (1S)-2-(3-bromo-4-fluoro-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) | 2.39 | 7.86 | -60.17 | 3 | 1 | 1 | 28 | 331.155 | 3 | ↓ |
Hi High (pH 8-9.5) | 2.39 | 7.53 | -6.13 | 2 | 1 | 0 | 26 | 330.147 | 3 | ↓ |