In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
September 24th, 2008 | 12 | No |
Popular Name: (3aR,5S,7aR)-5-methyl-3a,4,5,6,7,7a-hexahydroisoindole-1,3-dione (3aR,5S,7aR)-5-methyl-3a,4,5,6,7…
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) | 0.76 | 2.2 | -6.84 | 1 | 3 | 0 | 46 | 167.208 | 0 | ↓ |
Ref Reference (pH 7) | 0.76 | 1.92 | -5.85 | 1 | 3 | 0 | 46 | 167.208 | 0 | ↓ |