| In ZINC since | Heavy atoms | Benign functionality |
|---|---|---|
| August 16th, 2004 | 22 | Yes |
Popular Name: N-[5-(trifluoromethyl)-1,3,4-thiadiazol-2-yl]-2,3-dihydro-1,4-benzodioxine-2-carboxamide N-[5-(trifluoromethyl)-1,3,4-thi…
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CAS Number: 865660-10-2
| 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) | 1.60 | 5.15 | -18.25 | 1 | 6 | 0 | 73 | 331.275 | 3 | ↓ |
| Mid Mid (pH 6-8) | 1.79 | 2.66 | -39.64 | 0 | 6 | -1 | 80 | 330.267 | 3 | ↓ |
| Note Type | Comments | Provided By |
|---|---|---|
| melting_point | 146 - 148 | KeyOrganics |
No pre-computed analogs available. Try a structural similarity search.
