General Information of the Compound
| Compound ID |
CP0456314
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| Compound Name |
5-(1,3-benzodioxol-5-yl)-5-methyl-3-[4-[2-oxo-6,8-dipropyl-4-(trifluoromethyl)chromen-7-yl]oxybutyl]imidazolidine-2,4-dione
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| Structure |
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| Formula |
C31H33F3N2O7
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| Molecular Weight |
602.606
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| Canonical SMILES |
CCCc1cc2c(cc(=O)oc2c(CCC)c1OCCCCN1C(=O)NC(C)(C1=O)c1ccc2OCOc2c1)C(F)(F)F
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| InChI |
InChI=1S/C31H33F3N2O7/c1-4-8-18-14-21-22(31(32,33)34)16-25(37)43-27(21)20(9-5-2)26(18)40-13-7-6-12-36-28(38)30(3,35-29(36)39)19-10-11-23-24(15-19)42-17-41-23/h10-11,14-16H,4-9,12-13,17H2,1-3H3,(H,35,39)
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| InChIKey |
PWPAZGUJZWHURL-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