In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
November 18th, 2005 | 19 | No |
Popular Name: 4-[(4-fluorophenyl)methyleneamino]-5-(trifluoromethyl)-2H-1,2,4-triazole-3-thione 4-[(4-fluorophenyl)methyleneamin…
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) | 2.77 | 6.55 | -46.47 | 0 | 4 | -1 | 43 | 289.237 | 3 | ↓ |
Note Type | Comments | Provided By |
---|---|---|
mp | 210 | MolMall (formerly Molecular Diversity Preservation International) |
mp | 276 | MolMall (formerly Molecular Diversity Preservation International) |