General Information of the Compound
| Compound ID |
CP0378752
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| Compound Name |
1-((3-methyl-1-phenyl-1H-pyrazol-4-yl)methyl)-4-phenylpiperazine
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| Structure |
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| Formula |
C21H24N4
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| Molecular Weight |
332.451
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| Canonical SMILES |
Cc1nn(cc1CN1CCN(CC1)c1ccccc1)-c1ccccc1
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| InChI |
InChI=1S/C21H24N4/c1-18-19(17-25(22-18)21-10-6-3-7-11-21)16-23-12-14-24(15-13-23)20-8-4-2-5-9-20/h2-11,17H,12-16H2,1H3
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| InChIKey |
KMPUUVTZQFSTEA-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