| In ZINC since | Heavy atoms | Benign functionality |
|---|---|---|
| September 19th, 2011 | 24 | Yes |
Popular Name: (3S)-N,3-dimethyl-1-oxo-N-[(1S)-1-(2-pyridyl)ethyl]isochromane-3-carboxamide (3S)-N,3-dimethyl-1-oxo-N-[(1S)-…
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| 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) | 2.33 | 9.32 | -10.89 | 0 | 5 | 0 | 60 | 324.38 | 3 | ↓ |
| Lo Low (pH 4.5-6) | 2.33 | 9.53 | -36 | 1 | 5 | 1 | 61 | 325.388 | 3 | ↓ |
No pre-computed analogs available. Try a structural similarity search.
