General Information of the Compound
| Compound ID |
CP0545747
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| Compound Name |
9b-(1,3-benzodioxol-5-yl)-1-(3,4,5-trifluorobenzoyl)-2,3-dihydroimidazo[2,1-a]isoindol-5-one
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| Structure |
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| Formula |
C24H15F3N2O4
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| Molecular Weight |
452.388
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| Canonical SMILES |
Fc1cc(cc(F)c1F)C(=O)N1CCN2C(=O)c3ccccc3C12c1ccc2OCOc2c1
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| InChI |
InChI=1S/C24H15F3N2O4/c25-17-9-13(10-18(26)21(17)27)22(30)28-7-8-29-23(31)15-3-1-2-4-16(15)24(28,29)14-5-6-19-20(11-14)33-12-32-19/h1-6,9-11H,7-8,12H2
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| InChIKey |
WCYMQUYDJGSSJP-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