| In ZINC since | Heavy atoms | Benign functionality |
|---|---|---|
| May 23rd, 2008 | 14 | Yes |
Popular Name: 2-Hydroxy-2-(3,5-dimethoxyphenyl)ethylamine 2-Hydroxy-2-(3,5-dimethoxyphenyl…
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CAS Number: 91252-41-4
| 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) | -0.03 | -1.12 | -46.57 | 4 | 4 | 1 | 66 | 198.242 | 4 | ↓ |
| Note Type | Comments | Provided By |
|---|---|---|
| purity | 9.500000000000000e+001 | Enamine Building Blocks |
| MP | 92 - 94 | Enamine Building Blocks |
| MP | 92...94 | Enamine Building Blocks |
| purity | 95 | Enamine Building Blocks |
| Purity | 95% | Fluorochem |
| PUBCHEM_PATENT_ID | EP0654534A2; EP0654534A3; EP0654534B1; EP0924193A1; EP0924194A2; EP0939134A1; US5629200; US5811293; US6114582 | IBM Patent Data |
