In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
April 29th, 2010 | 18 | Yes |
Popular Name: (1S,2R,4R)-2-[(2R,5S)-5-ethyl-2-methyl-morpholin-4-yl]-4-methyl-cyclohexanecarbonitrile (1S,2R,4R)-2-[(2R,5S)-5-ethyl-2-…
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) | 2.98 | 5.36 | -7.2 | 0 | 3 | 0 | 36 | 250.386 | 2 | ↓ |
Mid Mid (pH 6-8) | 2.98 | 7.01 | -41.69 | 1 | 3 | 1 | 37 | 251.394 | 2 | ↓ |