| In ZINC since | Heavy atoms | Benign functionality |
|---|---|---|
| February 7th, 2009 | 19 | No |
Popular Name: (3aS,7aR)-2-(2-hydroxyphenyl)-7a-methyl-4,7-dihydro-3aH-isoindole-1,3-dione (3aS,7aR)-2-(2-hydroxyphenyl)-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) | 2.18 | 4.96 | -14.6 | 1 | 4 | 0 | 58 | 257.289 | 1 | ↓ |
| Hi High (pH 8-9.5) | 2.18 | 5.74 | -56.52 | 0 | 4 | -1 | 60 | 256.281 | 1 | ↓ |
