General Information of the Compound
| Compound ID |
CP0386633
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| Compound Name |
1-(4-bromophenyl)-4-(3-naphthalen-2-yloxypropyl)piperazine
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| Structure |
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| Formula |
C23H25BrN2O
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| Molecular Weight |
425.37
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| Canonical SMILES |
Brc1ccc(cc1)N1CCN(CCCOc2ccc3ccccc3c2)CC1
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| InChI |
InChI=1S/C23H25BrN2O/c24-21-7-9-22(10-8-21)26-15-13-25(14-16-26)12-3-17-27-23-11-6-19-4-1-2-5-20(19)18-23/h1-2,4-11,18H,3,12-17H2
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| InChIKey |
DCNUHNYKWGKPBK-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