General Information of the Compound
| Compound ID |
CP0930944
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| Compound Name |
1'-{2-[4-(2-Methoxyethyl)piperazin-1-yl]2-phenylethyl}[1,4']bipiperidinyl
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| Structure |
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| Formula |
C25H42N4O
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| Molecular Weight |
414.638
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| Canonical SMILES |
COCCN1CCN(C(CN2CCC(N3CCCCC3)CC2)c2ccccc2)CC1
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| InChI |
InChI=1S/C25H42N4O/c1-30-21-20-26-16-18-29(19-17-26)25(23-8-4-2-5-9-23)22-27-14-10-24(11-15-27)28-12-6-3-7-13-28/h2,4-5,8-9,24-25H,3,6-7,10-22H2,1H3
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| InChIKey |
ZPTHNOHTTUFGRD-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