General Information of the Compound
| Compound ID |
CP0337686
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| Compound Name |
N-[4-(4-phenylmethoxyanilino)quinazolin-6-yl]prop-2-enamide
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| Structure |
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| Formula |
C24H20N4O2
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| Molecular Weight |
396.45
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| Canonical SMILES |
C=CC(=O)Nc1ccc2ncnc(Nc3ccc(OCc4ccccc4)cc3)c2c1
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| InChI |
InChI=1S/C24H20N4O2/c1-2-23(29)27-19-10-13-22-21(14-19)24(26-16-25-22)28-18-8-11-20(12-9-18)30-15-17-6-4-3-5-7-17/h2-14,16H,1,15H2,(H,27,29)(H,25,26,28)
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| InChIKey |
YJJIOYPSLPQCAL-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