| In ZINC since | Heavy atoms | Benign functionality |
|---|---|---|
| November 10th, 2010 | 21 | Yes |
Popular Name: 5-[2-(dimethylamino)vinyl]-3-[(4-methylbenzyl)sulfanyl]-4-isothiazolecarbonitrile 5-[2-(dimethylamino)vinyl]-3-[(4…
Find On: PubMed — Wikipedia — Google
CAS Number: 338778-59-9
| 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) | 3.98 | 10.21 | -9.62 | 0 | 3 | 0 | 40 | 315.467 | 5 | ↓ |
| Note Type | Comments | Provided By |
|---|---|---|
| melting_point | 124 - 126 | KeyOrganics |
