| In ZINC since | Heavy atoms | Benign functionality |
|---|---|---|
| April 3rd, 2006 | 15 | No |
Popular Name: 5-(2-Ethoxy-phenyl)-4H-[1,2,4]triazole-3-thiol 5-(2-Ethoxy-phenyl)-4H-[1,2,4]tr…
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CAS Numbers: 19982-35-5 , [19982-35-5]
| 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) | 2.61 | 5.92 | -49.44 | 1 | 4 | -1 | 51 | 220.277 | 3 | ↓ |
| Mid Mid (pH 6-8) | 2.61 | 6.19 | -23.15 | 2 | 4 | 0 | 52 | 221.285 | 3 | ↓ |
| Note Type | Comments | Provided By |
|---|---|---|
| Warnings | IRRITANT | Matrix Scientific |
