General Information of the Compound
| Compound ID |
CP0523419
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| Compound Name |
9b-(3-methoxy-4-methylphenyl)-1-(3,4,5-trifluorobenzoyl)-2,3-dihydroimidazo[2,1-a]isoindol-5-one
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| Structure |
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| Formula |
C25H19F3N2O3
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| Molecular Weight |
452.432
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| Canonical SMILES |
COc1cc(ccc1C)C12N(CCN1C(=O)c1ccccc21)C(=O)c1cc(F)c(F)c(F)c1
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| InChI |
InChI=1S/C25H19F3N2O3/c1-14-7-8-16(13-21(14)33-2)25-18-6-4-3-5-17(18)24(32)30(25)10-9-29(25)23(31)15-11-19(26)22(28)20(27)12-15/h3-8,11-13H,9-10H2,1-2H3
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| InChIKey |
IKXVMZAMVPJCJU-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