In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
May 4th, 2010 | 20 | Yes |
Popular Name: (2S)-1-(3,4-difluorophenyl)-2-[ethyl-[(1R)-2-methoxy-1-methyl-ethyl]amino]propan-1-one (2S)-1-(3,4-difluorophenyl)-2-[e…
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) | 2.77 | 8.17 | -39.02 | 1 | 3 | 1 | 31 | 286.342 | 7 | ↓ |
Hi High (pH 8-9.5) | 2.77 | 5.94 | -9.45 | 0 | 3 | 0 | 30 | 285.334 | 7 | ↓ |