General Information of the Compound
| Compound ID |
CP0541067
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| Compound Name |
1-[2-[1-(3,4-dichlorophenyl)-5-methylpyrazol-3-yl]oxyethyl]-4-phenylpiperazine
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| Structure |
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| Formula |
C22H24Cl2N4O
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| Molecular Weight |
431.367
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| Canonical SMILES |
Cc1cc(OCCN2CCN(CC2)c2ccccc2)nn1-c1ccc(Cl)c(Cl)c1
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| InChI |
InChI=1S/C22H24Cl2N4O/c1-17-15-22(25-28(17)19-7-8-20(23)21(24)16-19)29-14-13-26-9-11-27(12-10-26)18-5-3-2-4-6-18/h2-8,15-16H,9-14H2,1H3
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| InChIKey |
QTQONWQMPDQYQI-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