General Information of the Compound
| Compound ID |
CP0505138
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| Compound Name |
1-(8-azabicyclo[3.2.1]octan-8-yl)-3-[5-(4-chlorophenyl)imidazo[1,2-b]isoindol-5-yl]propan-1-one
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| Structure |
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| Formula |
C26H26ClN3O
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| Molecular Weight |
431.967
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| Canonical SMILES |
Clc1ccc(cc1)C1(CCC(=O)N2C3CCC2CCC3)c2ccccc2-c2nccn12
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| InChI |
InChI=1S/C26H26ClN3O/c27-19-10-8-18(9-11-19)26(15-14-24(31)30-20-4-3-5-21(30)13-12-20)23-7-2-1-6-22(23)25-28-16-17-29(25)26/h1-2,6-11,16-17,20-21H,3-5,12-15H2
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| InChIKey |
HORZLDFSYQKFIK-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