| In ZINC since | Heavy atoms | Benign functionality |
|---|---|---|
| October 27th, 2004 | 12 | Yes |
Popular Name: 1-(3-Hydroxyphenyl)-2-(methylamino)ethanone hydrochloride 1-(3-Hydroxyphenyl)-2-(methylami…
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CAS Numbers: 1245808-25-6 , 94240-17-2 , [1245808-25-6] , [94240-17-2]
1-(3-Hydroxyphenyl)-2-(methylamino)ethanone sulfate
| 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) | 0.74 | 1.46 | -46.37 | 3 | 3 | 1 | 54 | 166.2 | 3 | ↓ |
| Mid Mid (pH 6-8) | 0.74 | -0.02 | -9.19 | 2 | 3 | 0 | 49 | 165.192 | 3 | ↓ |
| Note Type | Comments | Provided By |
|---|---|---|
| PUBCHEM_PATENT_ID | US3968147 | IBM Patent Data |
