In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
March 18th, 2009 | 29 | No |
Popular Name: 3-[(4-tert-butylphenoxy)methyl]-5-[(4-nitrophenyl)methylsulfanyl]-1,2,4-triazol-4-amine 3-[(4-tert-butylphenoxy)methyl]-…
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) | 4.78 | 12.15 | -15.25 | 2 | 8 | 0 | 112 | 413.503 | 8 | ↓ |