General Information of the Compound
| Compound ID |
CP0022969
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| Compound Name |
2-chloro-N-[3-[[4-(3-methoxyphenyl)phenyl]methyl]-4-oxo-2-propylquinazolin-6-yl]benzamide
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| Structure |
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| Formula |
C32H28ClN3O3
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| Molecular Weight |
538.047
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| Canonical SMILES |
CCCc1nc2ccc(NC(=O)c3ccccc3Cl)cc2c(=O)n1Cc1ccc(cc1)-c1cccc(OC)c1
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| InChI |
InChI=1S/C32H28ClN3O3/c1-3-7-30-35-29-17-16-24(34-31(37)26-10-4-5-11-28(26)33)19-27(29)32(38)36(30)20-21-12-14-22(15-13-21)23-8-6-9-25(18-23)39-2/h4-6,8-19H,3,7,20H2,1-2H3,(H,34,37)
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| InChIKey |
MJNUQNOAEWRZCF-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