General Information of the Compound
| Compound ID |
CP0514313
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| Compound Name |
Cyclohexanecarboxylic acid [(2-hydroxy-naphthalen-1-yl)-p-tolyl-methyl]-amide
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| Structure |
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| Formula |
C25H27NO2
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| Molecular Weight |
373.496
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| Canonical SMILES |
Cc1ccc(cc1)C(NC(=O)C1CCCCC1)c1c(O)ccc2ccccc12
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| InChI |
InChI=1S/C25H27NO2/c1-17-11-13-19(14-12-17)24(26-25(28)20-8-3-2-4-9-20)23-21-10-6-5-7-18(21)15-16-22(23)27/h5-7,10-16,20,24,27H,2-4,8-9H2,1H3,(H,26,28)
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| InChIKey |
AOJYUCODXLAKOU-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
Protein ID: PT06109, Geminin
Protein ID: PT06172, Mothers against decapentaplegic homolog 3