General Information of the Compound
| Compound ID |
CP0441173
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| Compound Name |
1-[[5,6-dimethyl-2-(1,3-thiazol-2-yl)thieno[2,3-d]pyrimidin-4-yl]amino]-3-methylpyrrole-2,5-dione
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| Structure |
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| Formula |
C16H13N5O2S2
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| Molecular Weight |
371.447
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| Canonical SMILES |
CC1=CC(=O)N(Nc2nc(nc3sc(C)c(C)c23)-c2nccs2)C1=O
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| InChI |
InChI=1S/C16H13N5O2S2/c1-7-6-10(22)21(16(7)23)20-12-11-8(2)9(3)25-14(11)19-13(18-12)15-17-4-5-24-15/h4-6H,1-3H3,(H,18,19,20)
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| InChIKey |
DBDGTNASZUPGNR-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