General Information of the Compound
| Compound ID |
CP0570682
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| Compound Name |
N-(2-bromo-4,6-difluorophenyl)-2-[6-[(E)-(2,4-dioxo-1,3-thiazolidin-5-ylidene)methyl]naphthalen-2-yl]oxyacetamide
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| Structure |
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| Formula |
C22H13BrF2N2O4S
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| Molecular Weight |
519.323
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| Canonical SMILES |
Fc1cc(F)c(NC(=O)COc2ccc3cc(\C=C4\SC(=O)NC4=O)ccc3c2)c(Br)c1
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| InChI |
InChI=1S/C22H13BrF2N2O4S/c23-16-8-14(24)9-17(25)20(16)26-19(28)10-31-15-4-3-12-5-11(1-2-13(12)7-15)6-18-21(29)27-22(30)32-18/h1-9H,10H2,(H,26,28)(H,27,29,30)/b18-6+
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| InChIKey |
VBAPRGNDRKQXHC-NGYBGAFCSA-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