In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
November 1st, 2008 | 18 | Yes |
Popular Name: 3-[(2S,6S)-2,6-dimethylmorpholine-4-carbonyl]benzonitrile 3-[(2S,6S)-2,6-dimethylmorpholin…
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) | 1.21 | 6.03 | -12.26 | 0 | 4 | 0 | 53 | 244.294 | 1 | ↓ |
No pre-computed analogs available. Try a structural similarity search.