In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
September 19th, 2010 | 26 | Yes |
Popular Name: 4-[[[4-[(2S,6S)-2,6-dimethylmorpholin-4-yl]-3-fluoro-phenyl]methylamino]methyl]benzonitrile 4-[[[4-[(2S,6S)-2,6-dimethylmorp…
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) | 3.42 | 10.63 | -63.64 | 2 | 4 | 1 | 53 | 354.449 | 5 | ↓ |
Mid Mid (pH 6-8) | 3.42 | 9.27 | -9.39 | 1 | 4 | 0 | 48 | 353.441 | 5 | ↓ |