General Information of the Compound
| Compound ID |
CP0409051
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| Compound Name |
4-(1-phenylpyrazol-4-yl)-7-(3-piperidin-1-ylpropoxy)quinoline
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| Structure |
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| Formula |
C26H28N4O
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| Molecular Weight |
412.537
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| Canonical SMILES |
C(COc1ccc2c(ccnc2c1)-c1cnn(c1)-c1ccccc1)CN1CCCCC1
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| InChI |
InChI=1S/C26H28N4O/c1-3-8-22(9-4-1)30-20-21(19-28-30)24-12-13-27-26-18-23(10-11-25(24)26)31-17-7-16-29-14-5-2-6-15-29/h1,3-4,8-13,18-20H,2,5-7,14-17H2
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| InChIKey |
BTNRRBHRYCSZMU-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