General Information of the Compound
| Compound ID |
CP0498164
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| Compound Name |
N-[[4-chloro-3-(7-methoxy-4-oxo-3H-quinazolin-2-yl)phenyl]methyl]-2-methylpropanamide
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| Structure |
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| Formula |
C20H20ClN3O3
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| Molecular Weight |
385.851
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| Canonical SMILES |
COc1ccc2c(c1)nc([nH]c2=O)-c1cc(CNC(=O)C(C)C)ccc1Cl
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| InChI |
InChI=1S/C20H20ClN3O3/c1-11(2)19(25)22-10-12-4-7-16(21)15(8-12)18-23-17-9-13(27-3)5-6-14(17)20(26)24-18/h4-9,11H,10H2,1-3H3,(H,22,25)(H,23,24,26)
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| InChIKey |
YSUKTVAFDYAGOL-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