General Information of the Compound
| Compound ID |
CP0658710
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| Compound Name |
4-((2-phenylhydrazono)(5,5,8,8-tetramethyl-5,6,7,8-tetrahydronaphthalen-2-yl)methyl)benzoic acid
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| Structure |
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| Formula |
C28H30N2O2
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| Molecular Weight |
426.56
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| Canonical SMILES |
CC1(C)CCC(C)(C)c2cc(/C(=N\Nc3ccccc3)c3ccc(C(=O)O)cc3)ccc21
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| InChI |
InChI=1S/C28H30N2O2/c1-27(2)16-17-28(3,4)24-18-21(14-15-23(24)27)25(30-29-22-8-6-5-7-9-22)19-10-12-20(13-11-19)26(31)32/h5-15,18,29H,16-17H2,1-4H3,(H,31,32)/b30-25-
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| InChIKey |
OHCIQZINRHEJEM-JVCXMKTPSA-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