In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
July 1st, 2008 | 16 | Yes |
Popular Name: 2-benzyl-1,2,7-thiadiazepane 1,1-dioxide 2-benzyl-1,2,7-thiadiazepane 1,1…
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CAS Numbers: 1017782-61-4 , N/A
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) | 1.28 | 2.88 | -8.49 | 1 | 4 | 0 | 49 | 240.328 | 2 | ↓ |
Note Type | Comments | Provided By |
---|---|---|
melting_point | 72 - 74 | KeyOrganics |
MP | 72-74° | Matrix Scientific |
Purity | >95% | Matrix Scientific |
Warnings | IRRITANT | Matrix Scientific |
No pre-computed analogs available. Try a structural similarity search.