In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
May 4th, 2010 | 20 | Yes |
Popular Name: (2S)-1-phenyl-2-[propyl(2,2,2-trifluoroethyl)amino]butan-1-one (2S)-1-phenyl-2-[propyl(2,2,2-tr…
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) | 4.16 | 8.19 | -4.23 | 0 | 2 | 0 | 20 | 287.325 | 8 | ↓ |
Mid Mid (pH 6-8) | 4.16 | 9.86 | -31.98 | 1 | 2 | 1 | 22 | 288.333 | 8 | ↓ |