In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
November 7th, 2004 | 31 | Yes |
Popular Name: 3-(4-tert-butylphenyl)-5-[(2-chloro-6-fluoro-benzyl)thio]-4-phenyl-1,2,4-triazole 3-(4-tert-butylphenyl)-5-[(2-chl…
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) | 7.81 | 17.21 | -12.45 | 0 | 3 | 0 | 31 | 451.998 | 6 | ↓ |