In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
August 6th, 2004 | 26 | Yes |
Popular Name: 2-({5-[4-(tert-butyl)phenyl]-4-methyl-4H-1,2,4-triazol-3-yl}thio)-1-phenylethan-1-one 2-({5-[4-(tert-butyl)phenyl]-4-m…
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) | 5.35 | 2.72 | -11.33 | 0 | 4 | 0 | 47 | 365.502 | 6 | ↓ |