General Information of the Compound
| Compound ID |
CP0905727
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| Compound Name |
1-(2-methoxyethyl)-4-(2-(4-(4-methylpiperazin-1-yl)piperidin-1-yl)-1-phenylethyl)piperazine
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| Structure |
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| Formula |
C25H43N5O
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| Molecular Weight |
429.653
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| Canonical SMILES |
COCCN1CCN(C(CN2CCC(N3CCN(C)CC3)CC2)c2ccccc2)CC1
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| InChI |
InChI=1S/C25H43N5O/c1-26-12-16-29(17-13-26)24-8-10-28(11-9-24)22-25(23-6-4-3-5-7-23)30-18-14-27(15-19-30)20-21-31-2/h3-7,24-25H,8-22H2,1-2H3
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| InChIKey |
CRXHJJIAIQAMPB-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