| In ZINC since | Heavy atoms | Benign functionality |
|---|---|---|
| December 12th, 2011 | 19 | Yes |
Popular Name: 4-{[(3,4-dimethoxyphenyl)amino]methyl}piperidin-4-ol 4-{[(3,4-dimethoxyphenyl)amino]m…
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CAS Number: 1353878-24-6
4-{[(3,4-Dimethoxyphenyl)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) | 0.70 | 1.36 | -46.56 | 4 | 5 | 1 | 67 | 267.349 | 5 | ↓ |
| Lo Low (pH 4.5-6) | 0.70 | 1.91 | -109.56 | 5 | 5 | 2 | 72 | 268.357 | 5 | ↓ |
| Note Type | Comments | Provided By |
|---|---|---|
| melting_point | 135 - 137 | KeyOrganics |
| MP | 135-137° | Matrix Scientific |
| Warnings | IRRITANT | Matrix Scientific |
No pre-computed analogs available. Try a structural similarity search.
