General Information of the Compound
| Compound ID |
CP0548656
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| Compound Name |
N-[2-methyl-3-[1-methyl-5-[4-(morpholine-4-carbonyl)-3-(prop-2-enoylamino)anilino]-6-oxopyridin-3-yl]phenyl]benzamide
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| Structure |
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| Formula |
C34H33N5O5
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| Molecular Weight |
591.668
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| Canonical SMILES |
Cc1c(NC(=O)c2ccccc2)cccc1-c1cc(Nc2ccc(C(=O)N3CCOCC3)c(NC(=O)C=C)c2)c(=O)n(C)c1
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| InChI |
InChI=1S/C34H33N5O5/c1-4-31(40)36-29-20-25(13-14-27(29)33(42)39-15-17-44-18-16-39)35-30-19-24(21-38(3)34(30)43)26-11-8-12-28(22(26)2)37-32(41)23-9-6-5-7-10-23/h4-14,19-21,35H,1,15-18H2,2-3H3,(H,36,40)(H,37,41)
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| InChIKey |
CQLXPTMEVADPSG-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