General Information of the Compound
| Compound ID |
CP0527475
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| Compound Name |
1-benzyl-4-[6-(3-ethoxyphenyl)-3-methyl-6-bicyclo[3.1.0]hexanyl]piperazine
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| Structure |
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| Formula |
C26H34N2O
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| Molecular Weight |
390.571
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| Canonical SMILES |
CCOc1cccc(c1)C1(C2CC(C)CC12)N1CCN(Cc2ccccc2)CC1
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| InChI |
InChI=1S/C26H34N2O/c1-3-29-23-11-7-10-22(18-23)26(24-16-20(2)17-25(24)26)28-14-12-27(13-15-28)19-21-8-5-4-6-9-21/h4-11,18,20,24-25H,3,12-17,19H2,1-2H3
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| InChIKey |
SBNRJNNLQXJARV-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