General Information of the Compound
| Compound ID |
CP0034633
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| Compound Name |
CHEBI:6822
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| Formula |
C5H8N4O3S2
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| Molecular Weight |
236.278
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| Canonical SMILES |
CC(=O)\N=c1\sc(nn1C)S(N)(=O)=O
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| InChI |
InChI=1S/C5H8N4O3S2/c1-3(10)7-4-9(2)8-5(13-4)14(6,11)12/h1-2H3,(H2,6,11,12)/b7-4+
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| InChIKey |
FLOSMHQXBMRNHR-QPJJXVBHSA-N
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| CAS |
554-57-4
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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