General Information of the Compound
| Compound ID |
CP0530181
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| Compound Name |
N-methoxy-1-(2-methoxyethyl)-N,5-dimethyl-2,4-dioxo-3-(2-phenylethyl)thieno[2,3-d]pyrimidine-6-carboxamide
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| Structure |
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| Formula |
C21H25N3O5S
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| Molecular Weight |
431.514
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| Canonical SMILES |
COCCn1c2sc(C(=O)N(C)OC)c(C)c2c(=O)n(CCc2ccccc2)c1=O
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| InChI |
InChI=1S/C21H25N3O5S/c1-14-16-18(25)23(11-10-15-8-6-5-7-9-15)21(27)24(12-13-28-3)20(16)30-17(14)19(26)22(2)29-4/h5-9H,10-13H2,1-4H3
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| InChIKey |
VFLCTBFKTBUXTM-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