General Information of the Compound
| Compound ID |
CP0869186
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| Compound Name |
N-(2-thioxoimidazolidine-1-carbothioyl)-pyridine-2-methylthio-3-carboxamide
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| Structure |
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| Formula |
C11H12N4OS3
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| Molecular Weight |
312.445
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| Canonical SMILES |
CSc1ncccc1C(=O)NC(=S)N1CCNC1=S
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| InChI |
InChI=1S/C11H12N4OS3/c1-19-9-7(3-2-4-12-9)8(16)14-11(18)15-6-5-13-10(15)17/h2-4H,5-6H2,1H3,(H,13,17)(H,14,16,18)
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| InChIKey |
XAPYTRNXHMAJRO-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