General Information of the Compound
| Compound ID |
CP0546026
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| Compound Name |
2-[(4-cyanophenyl)methoxy]-N-[6-[3-(dimethylamino)phenoxy]-4-oxo-3H-quinazolin-7-yl]acetamide
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| Formula |
C26H23N5O4
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| Molecular Weight |
469.501
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| Canonical SMILES |
CN(C)c1cccc(Oc2cc3c(cc2NC(=O)COCc2ccc(cc2)C#N)nc[nH]c3=O)c1
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| InChI |
InChI=1S/C26H23N5O4/c1-31(2)19-4-3-5-20(10-19)35-24-11-21-22(28-16-29-26(21)33)12-23(24)30-25(32)15-34-14-18-8-6-17(13-27)7-9-18/h3-12,16H,14-15H2,1-2H3,(H,30,32)(H,28,29,33)
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| InChIKey |
UQIMATACPAUGRC-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