| In ZINC since | Heavy atoms | Benign functionality |
|---|---|---|
| November 10th, 2010 | 22 | Yes |
Popular Name: 3-[(2,6-dichlorobenzyl)sulfanyl]-5-[2-(dimethylamino)vinyl]-4-isothiazolecarbonitrile 3-[(2,6-dichlorobenzyl)sulfanyl]…
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CAS Number: 338778-51-1
| 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) | 4.80 | 10.38 | -10.77 | 0 | 3 | 0 | 40 | 370.33 | 5 | ↓ |
| Note Type | Comments | Provided By |
|---|---|---|
| melting_point | 157 - 159 | KeyOrganics |
No pre-computed analogs available. Try a structural similarity search.
