General Information of the Compound
| Compound ID |
CP0119007
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| Compound Name |
1-(4-(1-hydroxy-2-(5H-imidazo[5,1-a]isoindol- 5-yl)ethyl)piperidin-1-yl)ethanone;
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| Structure |
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| Formula |
C19H23N3O2
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| Molecular Weight |
325.412
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| Canonical SMILES |
CC(=O)N1CCC(CC1)C(O)CC1c2ccccc2-c2cncn12
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| InChI |
InChI=1S/C19H23N3O2/c1-13(23)21-8-6-14(7-9-21)19(24)10-17-15-4-2-3-5-16(15)18-11-20-12-22(17)18/h2-5,11-12,14,17,19,24H,6-10H2,1H3
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| InChIKey |
TZLKQKCGJBWURI-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