General Information of the Compound
| Compound ID |
CP0425373
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| Compound Name |
(Z)-3-(4-tert-Butyl-phenyl)-N-(2,3-dihydro-benzo[1,4]dioxin-6-yl)-3-(4-trifluoromethyl-phenyl)-acrylamide
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| Structure |
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| Formula |
C28H26F3NO3
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| Molecular Weight |
481.514
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| Canonical SMILES |
CC(C)(C)c1ccc(cc1)C(=C\C(=O)Nc1ccc2OCCOc2c1)\c1ccc(cc1)C(F)(F)F
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| InChI |
InChI=1S/C28H26F3NO3/c1-27(2,3)20-8-4-18(5-9-20)23(19-6-10-21(11-7-19)28(29,30)31)17-26(33)32-22-12-13-24-25(16-22)35-15-14-34-24/h4-13,16-17H,14-15H2,1-3H3,(H,32,33)/b23-17-
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| InChIKey |
DWQUIDZKBNATQH-QJOMJCCJSA-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