| In ZINC since | Heavy atoms | Benign functionality |
|---|---|---|
| December 9th, 2010 | 14 | Yes |
Popular Name: 2-[(3aS,7aS)-1-oxo-3,4,5,6,7,7a-hexahydro-2H-isoindol-3a-yl]acetic 2-[(3aS,7aS)-1-oxo-3,4,5,6,7,7a-…
| 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) | 0.65 | 2.92 | -41.5 | 1 | 4 | -1 | 69 | 196.226 | 2 | ↓ |
| Lo Low (pH 4.5-6) | 0.65 | 0.95 | -7.92 | 2 | 4 | 0 | 66 | 197.234 | 2 | ↓ |
No pre-computed analogs available. Try a structural similarity search.
