| In ZINC since | Heavy atoms | Benign functionality |
|---|---|---|
| August 16th, 2004 | 23 | Yes |
Popular Name: 3-[4-(4-methoxyphenyl)piperazino]-5-(methylamino)-4-isothiazolecarbonitrile 3-[4-(4-methoxyphenyl)piperazino…
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CAS Number: 338410-20-1
| 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) | 2.60 | -4.58 | -8.84 | 1 | 6 | 0 | 64 | 329.429 | 4 | ↓ |
| Note Type | Comments | Provided By |
|---|---|---|
| melting_point | 196 - 198 | KeyOrganics |
No pre-computed analogs available. Try a structural similarity search.
