General Information of the Compound
| Compound ID |
CP0458537
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| Compound Name |
N-[1-[(E)-3-(4-fluorophenyl)prop-2-enyl]piperidin-4-yl]benzamide
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| Structure |
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| Formula |
C21H23FN2O
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| Molecular Weight |
338.426
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| Canonical SMILES |
Fc1ccc(\C=C\CN2CCC(CC2)NC(=O)c2ccccc2)cc1
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| InChI |
InChI=1S/C21H23FN2O/c22-19-10-8-17(9-11-19)5-4-14-24-15-12-20(13-16-24)23-21(25)18-6-2-1-3-7-18/h1-11,20H,12-16H2,(H,23,25)/b5-4+
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| InChIKey |
DRDSYHJROZDIBB-SNAWJCMRSA-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