General Information of the Compound
| Compound ID |
CP0054778
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| Compound Name |
CAS_93413-69-5
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| Synonyms |
1-[(1R)-2-(Dimethylamino)-1-(4-methoxyphenyl)ethyl]cyclohexanol
1-[2-(Dimethylamino)-1-(4-methoxyphenyl)ethyl]cyclohexanol
1-[2-(dimethylamino)-1-(4-methoxyphenyl)ethyl]cyclohexan-1-ol
1-[2-dimethylamino-1-(4-methoxyphenyl)ethyl]cyclohexan-1-ol
1-{2-(dimethylamino)-1-[4-(methyloxy)phenyl]ethyl}cyclohexanol
Efectin
Efectin (TN)
Elafax
N,N-dimethyl-2-(1-hydroxycyclohexyl)-2-(4-methoxyphenyl)ethylamine
Venlafaxina
Venlafaxina [INN-Spanish];Venlafaxine (Effexor)
Venlafaxine
Venlafaxine (INN)
Venlafaxine ER
Venlafaxine [BAN:INN]
Venlafaxine [INN:BAN]
VenlafaxineXR
Venlafaxinum
Venlafaxinum [INN-Latin]
Wy 45030
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| Structure |
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| Formula |
C17H27NO2
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| Molecular Weight |
277.408
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| Canonical SMILES |
COc1ccc(cc1)C(CN(C)C)C1(O)CCCCC1
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| InChI |
InChI=1S/C17H27NO2/c1-18(2)13-16(17(19)11-5-4-6-12-17)14-7-9-15(20-3)10-8-14/h7-10,16,19H,4-6,11-13H2,1-3H3
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| InChIKey |
PNVNVHUZROJLTJ-UHFFFAOYSA-N
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| CAS |
93413-69-5
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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
Cell-based Assay
Protein ID: PT01026, Sodium-dependent noradrenaline transporter
Cell-based Assay
Protein ID: PT00871, Sodium-dependent serotonin transporter
Cell-based Assay
Clinical Information about the Compound