In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
September 29th, 2008 | 21 | No |
Popular Name: (3aR,7aS)-2-[[(2,5-dimethylphenyl)amino]methyl]-3a,4,5,6,7,7a-hexahydroisoindole-1,3-dione (3aR,7aS)-2-[[(2,5-dimethylpheny…
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) | 3.29 | 7.93 | -6.35 | 1 | 4 | 0 | 49 | 286.375 | 3 | ↓ |
Ref Reference (pH 7) | 3.29 | 7.99 | -6.81 | 1 | 4 | 0 | 49 | 286.375 | 3 | ↓ |
No pre-computed analogs available. Try a structural similarity search.