General Information of the Compound
| Compound ID |
CP0659604
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| Compound Name |
(R)-1-(2-(2-ethoxyphenyl)-1-phenylethyl)piperazine hydrochloride
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| Structure |
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| Formula |
C20H27ClN2O
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| Molecular Weight |
346.902
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| Canonical SMILES |
CCOc1ccccc1C[C@H](c1ccccc1)N1CCNCC1.Cl
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| InChI |
InChI=1S/C20H26N2O.ClH/c1-2-23-20-11-7-6-10-18(20)16-19(17-8-4-3-5-9-17)22-14-12-21-13-15-22;/h3-11,19,21H,2,12-16H2,1H3;1H/t19-;/m1./s1
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| InChIKey |
YIQFFQJVNKNCNB-FSRHSHDFSA-N
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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