General Information of the Compound
| Compound ID |
CP0547377
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| Compound Name |
2-(5H-imidazo[5,1-a]isoindol-5-yl)-N-[(4-methoxyphenyl)methyl]acetamide
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| Structure |
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| Formula |
C20H19N3O2
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| Molecular Weight |
333.391
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| Canonical SMILES |
COc1ccc(CNC(=O)CC2c3ccccc3-c3cncn23)cc1
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| InChI |
InChI=1S/C20H19N3O2/c1-25-15-8-6-14(7-9-15)11-22-20(24)10-18-16-4-2-3-5-17(16)19-12-21-13-23(18)19/h2-9,12-13,18H,10-11H2,1H3,(H,22,24)
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| InChIKey |
QOPDEIKRZXLGPB-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