| In ZINC since | Heavy atoms | Benign functionality |
|---|---|---|
| September 27th, 2010 | 18 | No |
Popular Name: 3-[2-(4-nitrophenoxy)ethylsulfanyl]-4H-1,2,4-triazole 3-[2-(4-nitrophenoxy)ethylsulfan…
| 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) | 1.95 | 6.9 | -11.12 | 1 | 7 | 0 | 97 | 266.282 | 6 | ↓ |
| Hi High (pH 8-9.5) | 1.95 | 6.7 | -39.14 | 0 | 7 | -1 | 95 | 265.274 | 6 | ↓ |
No pre-computed analogs available. Try a structural similarity search.
