General Information of the Compound
| Compound ID |
CP0463671
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| Compound Name |
8-fluoro-2-(4-methylpiperazin-1-yl)-3-(4-phenoxyphenyl)quinazolin-4-one
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| Structure |
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| Formula |
C25H23FN4O2
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| Molecular Weight |
430.483
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| Canonical SMILES |
CN1CCN(CC1)c1nc2c(F)cccc2c(=O)n1-c1ccc(Oc2ccccc2)cc1
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| InChI |
InChI=1S/C25H23FN4O2/c1-28-14-16-29(17-15-28)25-27-23-21(8-5-9-22(23)26)24(31)30(25)18-10-12-20(13-11-18)32-19-6-3-2-4-7-19/h2-13H,14-17H2,1H3
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| InChIKey |
TZWWHUJKOSJSRB-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