General Information of the Compound
| Compound ID |
CP0521173
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| Compound Name |
2-cyclohexyl-N-[1-[(E)-3-(2-fluorophenyl)prop-2-enoyl]piperidin-4-yl]-2-phenylacetamide
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| Structure |
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| Formula |
C28H33FN2O2
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| Molecular Weight |
448.582
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| Canonical SMILES |
Fc1ccccc1\C=C\C(=O)N1CCC(CC1)NC(=O)C(C1CCCCC1)c1ccccc1
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| InChI |
InChI=1S/C28H33FN2O2/c29-25-14-8-7-9-21(25)15-16-26(32)31-19-17-24(18-20-31)30-28(33)27(22-10-3-1-4-11-22)23-12-5-2-6-13-23/h1,3-4,7-11,14-16,23-24,27H,2,5-6,12-13,17-20H2,(H,30,33)/b16-15+
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| InChIKey |
FKHZOLZMEFNZBC-FOCLMDBBSA-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