General Information of the Compound
| Compound ID |
CP0903825
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| Compound Name |
N-(4-Methyl-3-((1-nicotinoylpiperidin-4-yl)oxy)phenyl)quinoline-3-carboxamide
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| Structure |
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| Formula |
C28H26N4O3
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| Molecular Weight |
466.541
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| Canonical SMILES |
Cc1ccc(NC(=O)c2cnc3ccccc3c2)cc1OC1CCN(C(=O)c2cccnc2)CC1
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| InChI |
InChI=1S/C28H26N4O3/c1-19-8-9-23(31-27(33)22-15-20-5-2-3-7-25(20)30-18-22)16-26(19)35-24-10-13-32(14-11-24)28(34)21-6-4-12-29-17-21/h2-9,12,15-18,24H,10-11,13-14H2,1H3,(H,31,33)
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| InChIKey |
GFZQZMZPEHWNKM-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