General Information of the Compound
Compound ID |
CP0494257
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Compound Name |
6-fluoro-3-[4-(4-pyridin-2-ylpiperazin-1-yl)butyl]-1,3-dihydroindol-2-one
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Structure |
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Formula |
C21H25FN4O
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Molecular Weight |
368.456
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Canonical SMILES |
Fc1ccc2C(CCCCN3CCN(CC3)c3ccccn3)C(=O)Nc2c1
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InChI |
InChI=1S/C21H25FN4O/c22-16-7-8-17-18(21(27)24-19(17)15-16)5-2-4-10-25-11-13-26(14-12-25)20-6-1-3-9-23-20/h1,3,6-9,15,18H,2,4-5,10-14H2,(H,24,27)
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InChIKey |
NDEQQLAZHRZSEI-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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ChEMBL ID |
Map of Molecular Bioactivity Related to the Compound
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