General Information of the Compound
| Compound ID |
CP0045907
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| Compound Name |
6-ethyl-4-(4-phenyl-1-piperazinyl)thieno[2,3-d]pyrimidine
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| Structure |
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| Formula |
C18H20N4S
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| Molecular Weight |
324.453
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| Canonical SMILES |
CCc1cc2c(ncnc2s1)N1CCN(CC1)c1ccccc1
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| InChI |
InChI=1S/C18H20N4S/c1-2-15-12-16-17(19-13-20-18(16)23-15)22-10-8-21(9-11-22)14-6-4-3-5-7-14/h3-7,12-13H,2,8-11H2,1H3
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| InChIKey |
QLJQQYHYZBUQIJ-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