In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
December 13th, 2008 | 16 | Yes |
Popular Name: (2S)-2-(2,6-difluorophenyl)-2-pyrrolidin-1-yl-ethanamine (2S)-2-(2,6-difluorophenyl)-2-py…
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) | 1.36 | 3.9 | -39.78 | 3 | 2 | 1 | 31 | 227.278 | 3 | ↓ |
Hi High (pH 8-9.5) | 1.36 | 5.32 | -26.63 | 3 | 2 | 1 | 30 | 227.278 | 3 | ↓ |
Mid Mid (pH 6-8) | 1.36 | 5.63 | -103.6 | 4 | 2 | 2 | 32 | 228.286 | 3 | ↓ |