General Information of the Compound
| Compound ID |
CP0450924
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| Compound Name |
N-[4-[[2-methoxy-5-[4-oxo-3-(pyridin-4-ylmethyl)-1,2-dihydroquinazolin-2-yl]phenyl]methoxy]phenyl]acetamide
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| Structure |
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| Formula |
C30H28N4O4
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| Molecular Weight |
508.578
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| Canonical SMILES |
COc1ccc(cc1COc1ccc(NC(C)=O)cc1)C1Nc2ccccc2C(=O)N1Cc1ccncc1
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| InChI |
InChI=1S/C30H28N4O4/c1-20(35)32-24-8-10-25(11-9-24)38-19-23-17-22(7-12-28(23)37-2)29-33-27-6-4-3-5-26(27)30(36)34(29)18-21-13-15-31-16-14-21/h3-17,29,33H,18-19H2,1-2H3,(H,32,35)
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| InChIKey |
KWRBGSXUWDTWIN-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