In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
October 2nd, 2008 | 24 | No |
Popular Name: (3R,3aR,6aR)-2-(o-tolyl)-3-(p-tolyl)-3a,6a-dihydro-3H-pyrrolo[3,4-d]isoxazole-4,6-dione (3R,3aR,6aR)-2-(o-tolyl)-3-(p-to…
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) | 3.12 | 4.78 | -45.7 | 0 | 5 | -1 | 65 | 321.356 | 2 | ↓ |
Lo Low (pH 4.5-6) | 2.94 | 7.42 | -7.27 | 1 | 5 | 0 | 59 | 322.364 | 2 | ↓ |