General Information of the Compound
| Compound ID |
CP0875509
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| Compound Name |
SID49731807
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| Structure |
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| Formula |
C19H16ClN3O4S
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| Molecular Weight |
417.874
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| Canonical SMILES |
COc1ccccc1NC(=O)c1nc(S(=O)(=O)Cc2ccccc2)ncc1Cl
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| InChI |
InChI=1S/C19H16ClN3O4S/c1-27-16-10-6-5-9-15(16)22-18(24)17-14(20)11-21-19(23-17)28(25,26)12-13-7-3-2-4-8-13/h2-11H,12H2,1H3,(H,22,24)
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| InChIKey |
VXZKGQAIVGUCNP-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: PT06172, Mothers against decapentaplegic homolog 3
Protein ID: PT06124, Paired box protein Pax-8