General Information of the Compound
| Compound ID |
CP0448503
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| Compound Name |
1,6-Dibenzyl-indan-1-carboxylic acid (2,2-dimethyl-propyl)-amide
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| Structure |
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| Formula |
C29H33NO
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| Molecular Weight |
411.589
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| Canonical SMILES |
CC(C)(C)CNC(=O)C1(Cc2ccccc2)CCc2ccc(Cc3ccccc3)cc12
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| InChI |
InChI=1S/C29H33NO/c1-28(2,3)21-30-27(31)29(20-23-12-8-5-9-13-23)17-16-25-15-14-24(19-26(25)29)18-22-10-6-4-7-11-22/h4-15,19H,16-18,20-21H2,1-3H3,(H,30,31)
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| InChIKey |
JYGMGOJJQFYGHI-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