General Information of the Compound
| Compound ID |
CP0424758
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| Compound Name |
2-(benzyloxy)-5-(4-methylpiperazin-1-yl)-N-phenethylbenzenamine
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| Structure |
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| Formula |
C26H31N3O
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| Molecular Weight |
401.554
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| Canonical SMILES |
CN1CCN(CC1)c1ccc(OCc2ccccc2)c(NCCc2ccccc2)c1
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| InChI |
InChI=1S/C26H31N3O/c1-28-16-18-29(19-17-28)24-12-13-26(30-21-23-10-6-3-7-11-23)25(20-24)27-15-14-22-8-4-2-5-9-22/h2-13,20,27H,14-19,21H2,1H3
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| InChIKey |
QFZMKTVOJUEHMG-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