General Information of the Compound
| Compound ID |
CP0573182
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| Compound Name |
1-[4-[(7-ethoxy-6-fluoroquinazolin-4-yl)amino]phenyl]-3-phenylurea
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| Structure |
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| Formula |
C23H20FN5O2
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| Molecular Weight |
417.444
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| Canonical SMILES |
CCOc1cc2ncnc(Nc3ccc(NC(=O)Nc4ccccc4)cc3)c2cc1F
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| InChI |
InChI=1S/C23H20FN5O2/c1-2-31-21-13-20-18(12-19(21)24)22(26-14-25-20)27-16-8-10-17(11-9-16)29-23(30)28-15-6-4-3-5-7-15/h3-14H,2H2,1H3,(H,25,26,27)(H2,28,29,30)
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| InChIKey |
OIPMVVIBKQVFHF-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