In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
December 13th, 2010 | 18 | Yes |
Popular Name: (1S)-2-(2-bromophenyl)-1-(2,4-difluorophenyl)ethanamine (1S)-2-(2-bromophenyl)-1-(2,4-di…
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) | 2.25 | 7.98 | -38.37 | 3 | 1 | 1 | 28 | 313.165 | 3 | ↓ |
Hi High (pH 8-9.5) | 2.25 | 7.68 | -2.92 | 2 | 1 | 0 | 26 | 312.157 | 3 | ↓ |