General Information of the Compound
| Compound ID |
CP0426057
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| Compound Name |
ethyl N-[5-(4-oxo-3-phenylquinazolin-2-yl)-4-phenyl-1,3-thiazol-2-yl]carbamate
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| Structure |
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| Formula |
C26H20N4O3S
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| Molecular Weight |
468.538
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| Canonical SMILES |
CCOC(=O)Nc1nc(c(s1)-c1nc2ccccc2c(=O)n1-c1ccccc1)-c1ccccc1
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| InChI |
InChI=1S/C26H20N4O3S/c1-2-33-26(32)29-25-28-21(17-11-5-3-6-12-17)22(34-25)23-27-20-16-10-9-15-19(20)24(31)30(23)18-13-7-4-8-14-18/h3-16H,2H2,1H3,(H,28,29,32)
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| InChIKey |
WHFYSZHRYWYKJC-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