| In ZINC since | Heavy atoms | Benign functionality |
|---|---|---|
| December 11th, 2011 | 17 | Yes |
Popular Name: 4-{[(3,4-dimethylphenyl)amino]methyl}piperidin-4-ol 4-{[(3,4-dimethylphenyl)amino]me…
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CAS Number: 1353878-30-4
4-{[(3,4-Dimethylphenyl)amino]methyl}-piperidin-4-ol
| 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) | 1.88 | 3.38 | -40.94 | 4 | 3 | 1 | 49 | 235.351 | 3 | ↓ |
| Lo Low (pH 4.5-6) | 1.88 | 3.94 | -101.24 | 5 | 3 | 2 | 53 | 236.359 | 3 | ↓ |
| Note Type | Comments | Provided By |
|---|---|---|
| melting_point | 167 - 168 | KeyOrganics |
| MP | 167-168° | Matrix Scientific |
| Purity | >95% | Matrix Scientific |
| Warnings | IRRITANT | Matrix Scientific |
No pre-computed analogs available. Try a structural similarity search.
