General Information of the Compound
| Compound ID |
CP0872578
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| Compound Name |
SID57267384
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| Structure |
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| Formula |
C13H12N2O3S
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| Molecular Weight |
276.317
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| Canonical SMILES |
Cc1cnc(NC(=O)c2ccc3c(c2)OCCO3)s1
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| InChI |
InChI=1S/C13H12N2O3S/c1-8-7-14-13(19-8)15-12(16)9-2-3-10-11(6-9)18-5-4-17-10/h2-3,6-7H,4-5H2,1H3,(H,14,15,16)
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| InChIKey |
IEFYWLFWGKXTSE-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
Protein ID: PT06109, Geminin
Protein ID: PT02997, Isocitrate dehydrogenase [NADP] cytoplasmic
Protein ID: PT06124, Paired box protein Pax-8