General Information of the Compound
| Compound ID |
CP0553744
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| Compound Name |
6-(4-chlorophenyl)-3-(2-naphthalenyl)thieno[3,2-d]pyrimidin-4(3H)-one
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| Structure |
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| Formula |
C22H13ClN2OS
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| Molecular Weight |
388.879
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| Canonical SMILES |
Clc1ccc(cc1)-c1cc2ncn(-c3ccc4ccccc4c3)c(=O)c2s1
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| InChI |
InChI=1S/C22H13ClN2OS/c23-17-8-5-15(6-9-17)20-12-19-21(27-20)22(26)25(13-24-19)18-10-7-14-3-1-2-4-16(14)11-18/h1-13H
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| InChIKey |
XZNKOHFXNRRBKF-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