In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
September 19th, 2009 | 21 | Yes |
Popular Name: 3-[(2S)-3-[(2R,6R)-2,6-dimethylmorpholin-4-yl]-2-hydroxy-propoxy]benzonitrile 3-[(2S)-3-[(2R,6R)-2,6-dimethylm…
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) | 1.68 | 3.18 | -10.15 | 1 | 5 | 0 | 66 | 290.363 | 5 | ↓ |
Mid Mid (pH 6-8) | 1.68 | 5.16 | -47.63 | 2 | 5 | 1 | 67 | 291.371 | 5 | ↓ |