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Structure
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| Relationships |
Total Number of functionally related protein(s) :
84
Total Number of Articles : 92
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| PubChem |
127151
|
| Molecular Formula |
C19H23NO3 |
| SMILES |
CCOC1=CC=CC=C1O[C@@H]([C@H]2CNCCO2)C3=CC=CC=C3 |
| InChI |
InChI=1S/C19H23NO3/c1-2-21-16-10-6-7-11-17(16)23-19(15-8-4-3-5-9-15)18-14-20-12-13-22-18/h3-11,18-20H,2,12-14H2,1H3/t18-,19-/m1/s1 |
| synonyms |
- Reboxetine
- 71620-89-8
- Reboxetine [INN]
- (2R)-2-[(R)-(2-ethoxyphenoxy)-phenylmethyl]morpholine
- 105017-38-7
- 947S0YZ36I
- Reboxetine (INN)
- (2r)-2-[(R)-(2-Ethoxyphenoxy)(Phenyl)methyl]morpholine
- Reboxitine
- Morpholine, 2-[(R)-(2-ethoxyphenoxy)phenylmethyl]-, (2R)-rel-
- (R)-2-((R)-(2-ethoxyphenoxy)(phenyl)methyl)morpholine
- Morpholine, 2-((R)-(2-ethoxyphenoxy)phenylmethyl)-, (2R)-rel-
- Reboxetine [INN:BAN]
- UNII-947S0YZ36I
- Reboxe- tine
- Reboxetinemesylate
- HSDB 7701
- Morpholine, 2-[(2-ethoxyphenoxy)phenylmethyl]-, (R*,R*)-
- REBOXETINE [MI]
- REBOXETINE [HSDB]
- REBOXETINE [VANDF]
- (R,R)-(-)-Reboxetine
- REBOXETINE [WHO-DD]
- SCHEMBL34533
- CHEMBL383921
- DTXSID1048257
- CHEBI:135342
- BDBM388642
- DTXSID401315414
- BCP12060
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| Properties |
| Property |
Value |
| MW |
313.4 g/mol |
| HBD |
1 |
| HBA |
4 |
| Rotatable Bond Count |
6 |
| Exact Mass |
313.16779360 g/mol |
| Monoisotopic Mass |
313.16779360 g/mol |
| Heavy Atom Count |
23 |
| Isotope Atom Count |
0 |
| Atom Stereo Count |
2 |
| Covalent Unit Count |
1 |
| Complexity |
333 |
| xlogp |
3 |
| Topological Polar Surface Area |
39.7 |
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