General Information of the Compound
| Compound ID |
CP0574153
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| Compound Name |
2-(6-cyano-7-cyclopropylthieno[3,2-d]pyrimidin-4-yl)sulfanylacetic acid
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| Structure |
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| Formula |
C12H9N3O2S2
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| Molecular Weight |
291.357
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| Canonical SMILES |
OC(=O)CSc1ncnc2c(C3CC3)c(sc12)C#N
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| InChI |
InChI=1S/C12H9N3O2S2/c13-3-7-9(6-1-2-6)10-11(19-7)12(15-5-14-10)18-4-8(16)17/h5-6H,1-2,4H2,(H,16,17)
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| InChIKey |
GYZFOCGTGSTZHG-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