| In ZINC since | Heavy atoms | Benign functionality |
|---|---|---|
| November 10th, 2008 | 18 | Yes |
Popular Name: 3-{[2-(sec-Butyl)phenoxy]methyl}piperidinehydrochloride 3-{[2-(sec-Butyl)phenoxy]methyl}…
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CAS Numbers: 1220033-49-7 , N/A
3-((2-(sec-Butyl)phenoxy)methyl)piperidine hydrochloride
3-{[2-(sec-Butyl)phenoxy]methyl}piperidine hydrochloride
| 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) | 3.54 | 8.38 | -39.49 | 2 | 2 | 1 | 26 | 248.39 | 5 | ↓ |
| Note Type | Comments | Provided By |
|---|---|---|
| Warnings | IRRITANT | Matrix Scientific |
No pre-computed analogs available. Try a structural similarity search.