In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
October 11th, 2009 | 17 | Yes |
Popular Name: 2-fluoro-N1-[(1S)-1-(2-pyridyl)ethyl]benzene-1,4-diamine 2-fluoro-N1-[(1S)-1-(2-pyridyl)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) | 1.75 | 4.21 | -7.54 | 3 | 3 | 0 | 51 | 231.274 | 3 | ↓ |
Mid Mid (pH 6-8) | 1.75 | 4.39 | -34.17 | 4 | 3 | 1 | 52 | 232.282 | 3 | ↓ |