General Information of the Compound
| Compound ID |
CP0456313
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| Compound Name |
5-methyl-5-(4-nitrophenyl)-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 |
C30H32F3N3O7
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| Molecular Weight |
603.594
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| Canonical SMILES |
CCCc1cc2c(cc(=O)oc2c(CCC)c1OCCCCN1C(=O)NC(C)(C1=O)c1ccc(cc1)[N+]([O-])=O)C(F)(F)F
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| InChI |
InChI=1S/C30H32F3N3O7/c1-4-8-18-16-22-23(30(31,32)33)17-24(37)43-26(22)21(9-5-2)25(18)42-15-7-6-14-35-27(38)29(3,34-28(35)39)19-10-12-20(13-11-19)36(40)41/h10-13,16-17H,4-9,14-15H2,1-3H3,(H,34,39)
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| InChIKey |
JJPMMOQSPNZDRD-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