General Information of the Compound
| Compound ID |
CP0448908
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| Compound Name |
(3-Chloro-4-fluoro-phenyl)-[7-methoxy-6-(2-piperidin-1-yl-ethoxy)-quinazolin-4-yl]-amine
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| Structure |
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| Formula |
C22H24ClFN4O2
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| Molecular Weight |
430.911
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| Canonical SMILES |
COc1cc2ncnc(Nc3ccc(F)c(Cl)c3)c2cc1OCCN1CCCCC1
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| InChI |
InChI=1S/C22H24ClFN4O2/c1-29-20-13-19-16(12-21(20)30-10-9-28-7-3-2-4-8-28)22(26-14-25-19)27-15-5-6-18(24)17(23)11-15/h5-6,11-14H,2-4,7-10H2,1H3,(H,25,26,27)
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| InChIKey |
QXZNYTGAAOAYAM-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