In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
August 8th, 2004 | 21 | No |
Popular Name: 6-(4-nitrophenyl)-3-(trifluoromethyl)-[1,2,4]triazolo[3,4-b][1,3,4]thiadiazole 6-(4-nitrophenyl)-3-(trifluorome…
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) | 3.04 | 3.47 | -11.1 | 0 | 7 | 0 | 88 | 315.236 | 3 | ↓ |
Note Type | Comments | Provided By |
---|---|---|
mp | 213 | MolMall (formerly Molecular Diversity Preservation International) |