| In ZINC since | Heavy atoms | Benign functionality |
|---|---|---|
| July 23rd, 2004 | 21 | No |
Popular Name: 4-(2-Chloro-phenyl)-5-(4-methoxy-phenyl)-4H-[1,2,4]triazole-3-thiol 4-(2-Chloro-phenyl)-5-(4-methoxy…
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CAS Number: 193738-04-4
4-(2-Chloro-phenyl)-5-(4-methoxy-phenyl)-4H-
4-(2-chlorophenyl)-5-(4-methoxyphenyl)-4H-1,2,4-triazole-3-thiol
| 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) | 4.46 | 9.78 | -50.83 | 0 | 4 | -1 | 40 | 316.793 | 3 | ↓ |
| Mid Mid (pH 6-8) | 3.73 | 9.94 | -13.83 | 1 | 4 | 0 | 43 | 317.801 | 3 | ↓ |
No pre-computed analogs available. Try a structural similarity search.