General Information of the Compound
| Compound ID |
CP0438756
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| Compound Name |
1-(2-((2-cyclopropylphenoxy)methyl)phenyl)piperazine
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| Structure |
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| Formula |
C20H24N2O
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| Molecular Weight |
308.425
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| Canonical SMILES |
C(Oc1ccccc1C1CC1)c1ccccc1N1CCNCC1
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| InChI |
InChI=1S/C20H24N2O/c1-3-7-19(22-13-11-21-12-14-22)17(5-1)15-23-20-8-4-2-6-18(20)16-9-10-16/h1-8,16,21H,9-15H2
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| InChIKey |
OIRUCIGVEPJTON-UHFFFAOYSA-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: PT00819, 5-hydroxytryptamine receptor 1A
Protein ID: PT00884, Sodium-dependent dopamine transporter
Protein ID: PT01026, Sodium-dependent noradrenaline transporter
Protein ID: PT00871, Sodium-dependent serotonin transporter