General Information of the Compound
| Compound ID |
CP0479790
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| Compound Name |
(3-Chloro-4-fluoro-phenyl)-[7-methoxy-6-(3-piperidin-1-yl-propoxy)-quinazolin-4-yl]-amine
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| Structure |
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| Formula |
C23H26ClFN4O2
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| Molecular Weight |
444.938
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| Canonical SMILES |
COc1cc2ncnc(Nc3ccc(F)c(Cl)c3)c2cc1OCCCN1CCCCC1
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| InChI |
InChI=1S/C23H26ClFN4O2/c1-30-21-14-20-17(13-22(21)31-11-5-10-29-8-3-2-4-9-29)23(27-15-26-20)28-16-6-7-19(25)18(24)12-16/h6-7,12-15H,2-5,8-11H2,1H3,(H,26,27,28)
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| InChIKey |
IFIRBZOPPUFQRQ-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