In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
February 18th, 2006 | 25 | No |
Popular Name: 4-(4-phenoxyphenyl)-5-phenyl-2H-1,2,4-triazole-3-thione 4-(4-phenoxyphenyl)-5-phenyl-2H-…
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) | 5.32 | 12.91 | -50.21 | 0 | 4 | -1 | 40 | 344.419 | 4 | ↓ |
Mid Mid (pH 6-8) | 4.59 | 12.81 | -10.82 | 1 | 4 | 0 | 43 | 345.427 | 4 | ↓ |