| In ZINC since | Heavy atoms | Benign functionality |
|---|---|---|
| February 14th, 2006 | 18 | No |
Popular Name: 3-(allylsulfanyl)-5-(4-nitrophenyl)-4H-1,2,4-triazole 3-(allylsulfanyl)-5-(4-nitrophen…
| 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) | 3.03 | 7.74 | -8.16 | 1 | 6 | 0 | 87 | 262.294 | 5 | ↓ |
| Mid Mid (pH 6-8) | 3.03 | 7.59 | -36.05 | 0 | 6 | -1 | 86 | 261.286 | 5 | ↓ |
