In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
March 7th, 2010 | 28 | No |
Popular Name: 4-cyclohexyl-3-[(4-nitrophenyl)methylsulfanyl]-5-phenyl-1,2,4-triazole 4-cyclohexyl-3-[(4-nitrophenyl)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) | 5.95 | 14.85 | -12.69 | 0 | 6 | 0 | 77 | 394.5 | 6 | ↓ |