General Information of the Compound
| Compound ID |
CP0487755
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| Compound Name |
N-[[4-chloro-3-(7-chloro-4-oxo-6-pyridin-4-yl-3H-quinazolin-2-yl)phenyl]methyl]-2-methylpropanamide
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| Structure |
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| Formula |
C24H20Cl2N4O2
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| Molecular Weight |
467.356
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| Canonical SMILES |
CC(C)C(=O)NCc1ccc(Cl)c(c1)-c1nc2cc(Cl)c(cc2c(=O)[nH]1)-c1ccncc1
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| InChI |
InChI=1S/C24H20Cl2N4O2/c1-13(2)23(31)28-12-14-3-4-19(25)17(9-14)22-29-21-11-20(26)16(10-18(21)24(32)30-22)15-5-7-27-8-6-15/h3-11,13H,12H2,1-2H3,(H,28,31)(H,29,30,32)
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| InChIKey |
HQQMPYPZJDJFGJ-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