General Information of the Compound
| Compound ID |
CP0561940
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| Compound Name |
6-fluoro-5-(1-phenylpiperidin-4-yl)-5H-imidazo[5,1-a]isoindole
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| Structure |
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| Formula |
C21H20FN3
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| Molecular Weight |
333.41
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| Canonical SMILES |
Fc1cccc2-c3cncn3C(C3CCN(CC3)c3ccccc3)c12
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| InChI |
InChI=1S/C21H20FN3/c22-18-8-4-7-17-19-13-23-14-25(19)21(20(17)18)15-9-11-24(12-10-15)16-5-2-1-3-6-16/h1-8,13-15,21H,9-12H2
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| InChIKey |
DURRNOMJUBJEMB-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