General Information of the Compound
| Compound ID |
CP0083658
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| Compound Name |
(S,S)-reboxetine
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| Synonyms |
(+-)-(2R*)-2-((alphaR*)-alpha-(o-Ethoxyphenoxy)benzyl)morpholine
(2S)-2-[(S)-(2-ethoxyphenoxy)-phenyl-methyl]morpholine
(2S)-2-[(S)-(2-ethoxyphenoxy)-phenylmethyl]morpholine
(2S)-2-[(S)-2-ethoxyphenoxy(phenyl)methyl]morpholine
(S,S)-( )-Reboxetine
(S,S)-Reboxetine
(S,S)-reboxetine
2-((2-ethoxyphenoxy)benzyl)morpholine methanesulfonate
98819-76-2
Davedax
Esreboxetine
Esreboxetine (USAN/INN)
Esreboxetine [USAN:INN]
L8S50ZY490
NCGC00025335-01
Norebox
PNU 165442g
PNU-165442G
Prolift
Reboxetine mesylate
S-Reboxetine
SCHEMBL34534
Solvex
Tocris-1982
UNII-L8S50ZY490
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| Structure |
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| Formula |
C19H23NO3
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| Molecular Weight |
313.397
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| Canonical SMILES |
CCOc1ccccc1O[C@H]([C@@H]1CNCCO1)c1ccccc1
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| 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-/m0/s1
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| InChIKey |
CBQGYUDMJHNJBX-OALUTQOASA-N
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| CAS |
98769-81-4
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| Physicochemical Property |
"RO5" indicates the cutoff set by lipinski's rule of five: (1) Molecular weight less than 500 Dalton; (2) xlogp less than 5; (3) No more than 5 hbonddonor (Hydrogen Bond Donor Count); (4) No more than 10 hbondacc (Hydrogen Bond Acceptor Count); (5) No more than 10 rotbonds (Rotatable Bond Count). Show/Hide
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Map of Molecular Bioactivity Related to the Compound
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Map of Molecular Bioactivity Related to the Compound Compound Cell Line Protein Bioactivity Value: <= 0.1 μM > 0.1 μM and <= 10 μM > 10 μM Imprecise Activity |
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Table of Molecular Bioactivities Related to the Compound
Protein ID: PT00884, Sodium-dependent dopamine transporter
Protein ID: PT01026, Sodium-dependent noradrenaline transporter
Protein ID: PT00871, Sodium-dependent serotonin transporter
Clinical Information about the Compound