General Information of the Compound
| Compound ID |
CP0549079
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| Compound Name |
2-(5H-imidazo[5,1-a]isoindol-5-yl)-N-(pyridin-3-ylmethyl)acetamide
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| Structure |
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| Formula |
C18H16N4O
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| Molecular Weight |
304.353
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| Canonical SMILES |
O=C(CC1c2ccccc2-c2cncn12)NCc1cccnc1
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| InChI |
InChI=1S/C18H16N4O/c23-18(21-10-13-4-3-7-19-9-13)8-16-14-5-1-2-6-15(14)17-11-20-12-22(16)17/h1-7,9,11-12,16H,8,10H2,(H,21,23)
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| InChIKey |
XRZXKDHNDZCOCH-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