| In ZINC since | Heavy atoms | Benign functionality |
|---|---|---|
| November 21st, 2010 | 18 | Yes |
Popular Name: 2-isoindolin-2-yl-N-[[(3R)-tetrahydrofuran-3-yl]methyl]ethanamine 2-isoindolin-2-yl-N-[[(3R)-tetra…
| 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) | 1.25 | 6.94 | -128.63 | 3 | 3 | 2 | 30 | 248.37 | 5 | ↓ |
| Hi High (pH 8-9.5) | 1.25 | 5.61 | -38.63 | 2 | 3 | 1 | 26 | 247.362 | 5 | ↓ |
| Mid Mid (pH 6-8) | 1.25 | 4.38 | -45.79 | 2 | 3 | 1 | 29 | 247.362 | 5 | ↓ |
No pre-computed analogs available. Try a structural similarity search.
