General Information of the Compound
| Compound ID |
CP0452467
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| Compound Name |
2-ethoxy-N-[[1-(4-phenylpiperazin-1-yl)cyclohexyl]methyl]benzamide
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| Structure |
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| Formula |
C26H35N3O2
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| Molecular Weight |
421.585
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| Canonical SMILES |
CCOc1ccccc1C(=O)NCC1(CCCCC1)N1CCN(CC1)c1ccccc1
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| InChI |
InChI=1S/C26H35N3O2/c1-2-31-24-14-8-7-13-23(24)25(30)27-21-26(15-9-4-10-16-26)29-19-17-28(18-20-29)22-11-5-3-6-12-22/h3,5-8,11-14H,2,4,9-10,15-21H2,1H3,(H,27,30)
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| InChIKey |
QLUDDTVPEHHTBK-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