| In ZINC since | Heavy atoms | Benign functionality |
|---|---|---|
| January 28th, 2011 | 26 | No |
Popular Name: 3-(3,4-dimethylphenyl)-4-[4-(trifluoromethoxy)anilino]cyclobut-3-ene-1,2-dione 3-(3,4-dimethylphenyl)-4-[4-(tri…
None
| 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) | 4.01 | 8.57 | -6.45 | 0 | 4 | 0 | 56 | 361.319 | 4 | ↓ |
| Mid Mid (pH 6-8) | 4.01 | 8.45 | -7.76 | 0 | 4 | 0 | 56 | 361.319 | 4 | ↓ |
No pre-computed analogs available. Try a structural similarity search.
