General Information of the Compound
| Compound ID |
CP0456426
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| Compound Name |
1-(2-(naphthalen-2-yl)-1-phenylethyl)piperazine
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| Synonyms |
1-(2-(naphthalen-2-yl)-1-phenylethyl)piperazine
CHEMBL425961
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| Structure |
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| Formula |
C22H24N2
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| Molecular Weight |
316.448
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| Canonical SMILES |
C(C(N1CCNCC1)c1ccccc1)c1ccc2ccccc2c1
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| InChI |
InChI=1S/C22H24N2/c1-2-7-20(8-3-1)22(24-14-12-23-13-15-24)17-18-10-11-19-6-4-5-9-21(19)16-18/h1-11,16,22-23H,12-15,17H2
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| InChIKey |
HSPJWADLPHSZQN-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: PT01026, Sodium-dependent noradrenaline transporter
Protein ID: PT00871, Sodium-dependent serotonin transporter
Clinical Information about the Compound