In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
December 12th, 2010 | 21 | Yes |
Popular Name: (1S)-1-(3,4-difluorophenyl)-2-(3,5-difluorophenyl)-N-ethyl-ethanamine (1S)-1-(3,4-difluorophenyl)-2-(3…
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) | 4.37 | 9.71 | -60.61 | 2 | 1 | 1 | 17 | 298.303 | 5 | ↓ |
Hi High (pH 8-9.5) | 4.37 | 8.87 | -6.27 | 1 | 1 | 0 | 12 | 297.295 | 5 | ↓ |