In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
March 4th, 2006 | 23 | Yes |
Popular Name: 3-(2-bromophenyl)-5-[2-(4-methylphenoxy)ethylsulfanyl]-2H-1,2,4-triazole 3-(2-bromophenyl)-5-[2-(4-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) | 5.32 | 10.58 | -11.49 | 1 | 4 | 0 | 51 | 390.306 | 6 | ↓ |
Hi High (pH 8-9.5) | 5.32 | 10.42 | -44.47 | 0 | 4 | -1 | 49 | 389.298 | 6 | ↓ |