General Information of the Compound
| Compound ID |
CP0222600
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| Compound Name |
5-nitro-2-(4-pyrimidinylthio)thiazole
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| Structure |
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| Formula |
C7H4N4O2S2
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| Molecular Weight |
240.269
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| Canonical SMILES |
[O-][N+](=O)c1cnc(Sc2ccncn2)s1
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| InChI |
InChI=1S/C7H4N4O2S2/c12-11(13)6-3-9-7(15-6)14-5-1-2-8-4-10-5/h1-4H
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| InChIKey |
SPNKLYOUOJJHBK-UHFFFAOYSA-N
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| CAS |
75464-90-3
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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
Protein ID: PT06109, Geminin
Protein ID: PT02997, Isocitrate dehydrogenase [NADP] cytoplasmic
Protein ID: PT06172, Mothers against decapentaplegic homolog 3