In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
September 15th, 2010 | 18 | Yes |
Popular Name: 3-ethyl-5-[2-(4-methylphenoxy)ethylsulfanyl]-4H-1,2,4-triazole 3-ethyl-5-[2-(4-methylphenoxy)et…
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) | 3.10 | 7.35 | -7.31 | 1 | 4 | 0 | 51 | 263.366 | 6 | ↓ |
Hi High (pH 8-9.5) | 3.10 | 7.16 | -41.91 | 0 | 4 | -1 | 49 | 262.358 | 6 | ↓ |