General Information of the Compound
| Compound ID |
CP0392411
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| Compound Name |
1-[(E)-5,5-diphenylpent-2-enyl]piperidine-3-carboxylic acid
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| Structure |
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| Formula |
C23H27NO2
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| Molecular Weight |
349.474
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| Canonical SMILES |
OC(=O)C1CCCN(C\C=C\CC(c2ccccc2)c2ccccc2)C1
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| InChI |
InChI=1S/C23H27NO2/c25-23(26)21-14-9-17-24(18-21)16-8-7-15-22(19-10-3-1-4-11-19)20-12-5-2-6-13-20/h1-8,10-13,21-22H,9,14-18H2,(H,25,26)/b8-7+
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| InChIKey |
VCTODHAXVTUVJZ-BQYQJAHWSA-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