| In ZINC since | Heavy atoms | Benign functionality |
|---|---|---|
| February 3rd, 2010 | 16 | Yes |
Popular Name: 3-Amino-4-methyl-benzo[b]thiophene-2-carboxylic acid ethyl ester 3-Amino-4-methyl-benzo[b]thiophe…
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CAS Number: 181284-94-6
ethyl 3-amino-4-methyl-1-benzothiophene-2-carboxylate
| 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) | 3.16 | 6.47 | -7.97 | 2 | 3 | 0 | 52 | 235.308 | 3 | ↓ |
| Note Type | Comments | Provided By |
|---|---|---|
| Purity | 95% | Fluorochem |
