General Information of the Compound
| Compound ID |
CP0545408
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| Compound Name |
[4-[3-[4-(2-methoxyphenyl)piperazin-1-yl]propyl]piperazin-1-yl]-pyridin-2-ylmethanone
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| Structure |
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| Formula |
C24H33N5O2
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| Molecular Weight |
423.561
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| Canonical SMILES |
COc1ccccc1N1CCN(CCCN2CCN(CC2)C(=O)c2ccccn2)CC1
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| InChI |
InChI=1S/C24H33N5O2/c1-31-23-9-3-2-8-22(23)28-17-13-26(14-18-28)11-6-12-27-15-19-29(20-16-27)24(30)21-7-4-5-10-25-21/h2-5,7-10H,6,11-20H2,1H3
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| InChIKey |
JMJMAIPPNDZPFH-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