General Information of the Compound
| Compound ID |
CP0883411
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| Compound Name |
(E)-1-(2-{2-[2-(4-tert-Butyl-phenyl)-vinyl]-1H-benzoimidazol-5-yl}-phenyl)-ethanol
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| Structure |
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| Formula |
C27H28N2O
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| Molecular Weight |
396.534
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| Canonical SMILES |
CC(O)c1ccccc1-c1ccc2[nH]c(/C=C/c3ccc(C(C)(C)C)cc3)nc2c1
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| InChI |
InChI=1S/C27H28N2O/c1-18(30)22-7-5-6-8-23(22)20-12-15-24-25(17-20)29-26(28-24)16-11-19-9-13-21(14-10-19)27(2,3)4/h5-18,30H,1-4H3,(H,28,29)/b16-11+
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| InChIKey |
JOVJTERTKUPLKL-LFIBNONCSA-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