| In ZINC since | Heavy atoms | Benign functionality |
|---|---|---|
| November 7th, 2004 | 9 | Yes |
Popular Name: (2-methyl-1,3-thiazol-4-yl)acetonitrile (2-methyl-1,3-thiazol-4-yl)aceto…
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CAS Number: 13458-33-8
| 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) | 0.79 | 3.49 | -10.59 | 0 | 2 | 0 | 37 | 138.195 | 1 | ↓ |
| Note Type | Comments | Provided By |
|---|---|---|
| MP | 272 - 274 | Enamine Building Blocks |
| MP | 272...274 | Enamine Building Blocks |
| purity | 9.500000000000000e+001 | Enamine Building Blocks Enamine Building Blocks |
No pre-computed analogs available. Try a structural similarity search.