General Information of the Compound
| Compound ID |
CP0699254
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| Compound Name |
SID24813175
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| Structure |
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| Formula |
C18H17N3O4S
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| Molecular Weight |
371.418
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| Canonical SMILES |
CCS(=O)(=O)c1ccc(N=Nc2ccc(O)c3ncccc23)c(OC)c1
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| InChI |
InChI=1S/C18H17N3O4S/c1-3-26(23,24)12-6-7-15(17(11-12)25-2)21-20-14-8-9-16(22)18-13(14)5-4-10-19-18/h4-11,22H,3H2,1-2H3
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| InChIKey |
JIVCISAVUBTQRK-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: PT06033, Microphthalmia-associated transcription factor
Protein ID: PT06124, Paired box protein Pax-8