General Information of the Compound
| Compound ID |
CP0528139
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| Compound Name |
6-[4-(2-methoxyphenyl)piperazin-1-yl]-N-(8-methoxy-1,2,3,4-tetrahydronaphthalen-1-yl)hexanamide
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| Structure |
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| Formula |
C28H39N3O3
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| Molecular Weight |
465.638
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| Canonical SMILES |
COc1ccccc1N1CCN(CCCCCC(=O)NC2CCCc3cccc(OC)c23)CC1
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| InChI |
InChI=1S/C28H39N3O3/c1-33-25-14-6-5-13-24(25)31-20-18-30(19-21-31)17-7-3-4-16-27(32)29-23-12-8-10-22-11-9-15-26(34-2)28(22)23/h5-6,9,11,13-15,23H,3-4,7-8,10,12,16-21H2,1-2H3,(H,29,32)
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| InChIKey |
PMRDKFPBXSXGDW-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