In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
October 2nd, 2009 | 19 | Yes |
Popular Name: (2S,6R)-N-[(1S)-1-(2,4-difluorophenyl)ethyl]-2,6-dimethyl-cyclohexanamine (2S,6R)-N-[(1S)-1-(2,4-difluorop…
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) | 4.70 | 9.56 | -38.4 | 2 | 1 | 1 | 17 | 268.371 | 3 | ↓ |
Hi High (pH 8-9.5) | 4.70 | 8.98 | -1.96 | 1 | 1 | 0 | 12 | 267.363 | 3 | ↓ |