In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
December 3rd, 2008 | 25 | Yes |
Popular Name: 3-[2-(4-chlorophenoxy)ethylsulfanyl]-5-[(4-chlorophenoxy)methyl]-4H-1,2,4-triazole 3-[2-(4-chlorophenoxy)ethylsulfa…
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) | 5.10 | 9.81 | -12.28 | 1 | 5 | 0 | 60 | 396.299 | 8 | ↓ |
Hi High (pH 8-9.5) | 5.10 | 9.67 | -39.24 | 0 | 5 | -1 | 58 | 395.291 | 8 | ↓ |