In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
October 12th, 2004 | 27 | No |
Popular Name: 4-ethyl-3-({4-nitrobenzyl}sulfanyl)-5-{4-nitrophenyl}-4H-1,2,4-triazole 4-ethyl-3-({4-nitrobenzyl}sulfan…
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) | 4.38 | 2.77 | -15.13 | 0 | 9 | 0 | 122 | 385.405 | 7 | ↓ |