| In ZINC since | Heavy atoms | Benign functionality |
|---|---|---|
| March 2nd, 2010 | 14 | No |
Popular Name: 3-methyl-5-trifluoromethylnitrobenzene 3-methyl-5-trifluoromethylnitrob…
Find On: PubMed — Wikipedia — Google
CAS Numbers: 96783-80-1 , [96783-80-1]
| 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) | 3.17 | 6.87 | -5.6 | 0 | 3 | 0 | 46 | 205.135 | 2 | ↓ |
| Hi High (pH 8-9.5) | 2.98 | 8.08 | -17.09 | 3 | 7 | 0 | 107 | 436.397 | 5 | ↓ |
