General Information of the Compound
| Compound ID |
CP0871356
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| Compound Name |
SID17516736
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| Structure |
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| Formula |
C19H15Cl2N3O4S
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| Molecular Weight |
452.319
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| Canonical SMILES |
COc1ccccc1NS(=O)(=O)c1cc(NC(=O)c2ccc(Cl)nc2)ccc1Cl
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| InChI |
InChI=1S/C19H15Cl2N3O4S/c1-28-16-5-3-2-4-15(16)24-29(26,27)17-10-13(7-8-14(17)20)23-19(25)12-6-9-18(21)22-11-12/h2-11,24H,1H3,(H,23,25)
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| InChIKey |
OWGJZDPJTNDBJE-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: PT02997, Isocitrate dehydrogenase [NADP] cytoplasmic
Protein ID: PT06033, Microphthalmia-associated transcription factor