| In ZINC since | Heavy atoms | Benign functionality |
|---|---|---|
| March 7th, 2010 | 25 | No |
Popular Name: 3-(3-nitrophenyl)-5-[(4-nitrophenyl)methylsulfanyl]-4H-1,2,4-triazole 3-(3-nitrophenyl)-5-[(4-nitrophe…
| 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) | 3.91 | 10.93 | -16.02 | 1 | 9 | 0 | 133 | 357.351 | 6 | ↓ |
| Mid Mid (pH 6-8) | 3.91 | 10.71 | -41.68 | 0 | 9 | -1 | 132 | 356.343 | 6 | ↓ |
