In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
November 6th, 2010 | 21 | Yes |
Popular Name: 3-fluoro-4-[[[(1R)-1-(2-fluorophenyl)ethyl]-methyl-amino]methyl]benzonitrile 3-fluoro-4-[[[(1R)-1-(2-fluoroph…
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) | 3.66 | 10.92 | -42.24 | 1 | 2 | 1 | 28 | 287.333 | 4 | ↓ |
Mid Mid (pH 6-8) | 3.66 | 9.53 | -8.22 | 0 | 2 | 0 | 27 | 286.325 | 4 | ↓ |