| In ZINC since | Heavy atoms | Benign functionality |
|---|---|---|
| October 27th, 2004 | 30 | Yes |
Popular Name: 3-[(3,4-dichlorobenzyl)sulfanyl]-5-(4-ethoxyphenyl)-4-phenyl-4H-1,2,4-triazole 3-[(3,4-dichlorobenzyl)sulfanyl]…
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CAS Number: 868255-98-5
| 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) | 7.08 | 1.95 | -10.26 | 0 | 4 | 0 | 39 | 456.398 | 7 | ↓ |
| Note Type | Comments | Provided By |
|---|---|---|
| melting_point | 144 - 146 | KeyOrganics |
