General Information of the Compound
| Compound ID |
CP0891960
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| Compound Name |
(Z)-N-(4-(3,4-difluorophenyl)thiazol-2-yl)-4-((2,4-dioxothiazolidin-5-ylidene)methyl)benzamide
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| Structure |
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| Formula |
C20H11F2N3O3S2
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| Molecular Weight |
443.456
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| Canonical SMILES |
O=C1NC(=O)/C(=C/c2ccc(C(=O)Nc3nc(-c4ccc(F)c(F)c4)cs3)cc2)S1
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| InChI |
InChI=1S/C20H11F2N3O3S2/c21-13-6-5-12(8-14(13)22)15-9-29-19(23-15)24-17(26)11-3-1-10(2-4-11)7-16-18(27)25-20(28)30-16/h1-9H,(H,23,24,26)(H,25,27,28)/b16-7-
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| InChIKey |
XANYDTDNPVDRJP-APSNUPSMSA-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