| In ZINC since | Heavy atoms | Benign functionality |
|---|---|---|
| November 9th, 2004 | 13 | Yes |
Popular Name: 2-(3-methyl-2-thienyl)azepane 2-(3-methyl-2-thienyl)azepane
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CAS Numbers: , 527674-19-7
| 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) | 3.37 | 6.37 | -33.83 | 2 | 1 | 1 | 17 | 196.339 | 1 | ↓ |
| Hi High (pH 8-9.5) | 3.37 | 5.09 | -1.89 | 1 | 1 | 0 | 12 | 195.331 | 1 | ↓ |
| Note Type | Comments | Provided By |
|---|---|---|
| Warnings | IRRITANT | Matrix Scientific |
