In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
May 13th, 2009 | 22 | No |
Popular Name: 5-[1-(4-bromophenoxy)ethyl]-4-cyclohexyl-4H-1,2,4-triazole-3-thiol 5-[1-(4-bromophenoxy)ethyl]-4-cy…
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) | 4.28 | 10.77 | -13.75 | 1 | 4 | 0 | 43 | 382.327 | 4 | ↓ |
Mid Mid (pH 6-8) | 5.01 | 10.61 | -46.28 | 0 | 4 | -1 | 40 | 381.319 | 4 | ↓ |