General Information of the Compound
| Compound ID |
CP0427653
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| Compound Name |
2-(5H-imidazo[5,1-a]isoindol-5-yl)-N-[2-(3-methoxyphenyl)ethyl]acetamide
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| Structure |
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| Formula |
C21H21N3O2
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| Molecular Weight |
347.418
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| Canonical SMILES |
COc1cccc(CCNC(=O)CC2c3ccccc3-c3cncn23)c1
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| InChI |
InChI=1S/C21H21N3O2/c1-26-16-6-4-5-15(11-16)9-10-23-21(25)12-19-17-7-2-3-8-18(17)20-13-22-14-24(19)20/h2-8,11,13-14,19H,9-10,12H2,1H3,(H,23,25)
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| InChIKey |
AKOWXTHGWKXKTH-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