General Information of the Compound
| Compound ID |
CP0742714
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| Compound Name |
4-{[6-(3-Chloropyridin-4-yl)quinazolin-2-yl]amino}-N-(2-methoxyethyl)benzamide
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| Structure |
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| Formula |
C23H20ClN5O2
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| Molecular Weight |
433.899
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| Canonical SMILES |
COCCNC(=O)c1ccc(Nc2ncc3cc(-c4ccncc4Cl)ccc3n2)cc1
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| InChI |
InChI=1S/C23H20ClN5O2/c1-31-11-10-26-22(30)15-2-5-18(6-3-15)28-23-27-13-17-12-16(4-7-21(17)29-23)19-8-9-25-14-20(19)24/h2-9,12-14H,10-11H2,1H3,(H,26,30)(H,27,28,29)
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| InChIKey |
WRCBLGSACDRFRX-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