General Information of the Compound
| Compound ID |
CP0547730
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| Compound Name |
6-fluoro-5-[1-(4-pyridin-4-ylphenyl)piperidin-4-yl]-5H-imidazo[5,1-a]isoindole
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| Structure |
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| Formula |
C26H23FN4
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| Molecular Weight |
410.496
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| Canonical SMILES |
Fc1cccc2-c3cncn3C(C3CCN(CC3)c3ccc(cc3)-c3ccncc3)c12
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| InChI |
InChI=1S/C26H23FN4/c27-23-3-1-2-22-24-16-29-17-31(24)26(25(22)23)20-10-14-30(15-11-20)21-6-4-18(5-7-21)19-8-12-28-13-9-19/h1-9,12-13,16-17,20,26H,10-11,14-15H2
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| InChIKey |
OHOFRSZOPPTEEB-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