| In ZINC since | Heavy atoms | Benign functionality |
|---|---|---|
| October 29th, 2011 | 23 | Yes |
Popular Name: 4-[(2S)-3-[(2R)-2-(dimethylaminomethyl)morpholin-4-yl]-2-hydroxy-propoxy]benzonitrile 4-[(2S)-3-[(2R)-2-(dimethylamino…
| 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) | 1.00 | 3.57 | -41.17 | 2 | 6 | 1 | 70 | 320.413 | 7 | ↓ |
| Hi High (pH 8-9.5) | 1.00 | 1.03 | -10.31 | 1 | 6 | 0 | 69 | 319.405 | 7 | ↓ |
No pre-computed analogs available. Try a structural similarity search.
