| In ZINC since | Heavy atoms | Benign functionality |
|---|---|---|
| December 19th, 2008 | 26 | Yes |
Popular Name: (3S)-N-[(2S)-2-dimethylamino-3-phenyl-propyl]-1-oxo-isochroman-3-carboxamide (3S)-N-[(2S)-2-dimethylamino-3-p…
| 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) | 2.68 | 11.51 | -62.22 | 2 | 5 | 1 | 60 | 353.442 | 6 | ↓ |
| Hi High (pH 8-9.5) | 2.68 | 9.39 | -19.28 | 1 | 5 | 0 | 59 | 352.434 | 6 | ↓ |
No pre-computed analogs available. Try a structural similarity search.
