General Information of the Compound
| Compound ID |
CP0506035
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| Compound Name |
5-(4-chlorobenzyl)-2-(naphthalen-1-yl)-1-(1,4-dioxaspiro[4.5]decan-8-yl)-1H-imidazole
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| Structure |
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| Formula |
C28H27ClN2O2
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| Molecular Weight |
458.989
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| Canonical SMILES |
Clc1ccc(Cc2cnc(-c3cccc4ccccc34)n2C2CCC3(CC2)OCCO3)cc1
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| InChI |
InChI=1S/C28H27ClN2O2/c29-22-10-8-20(9-11-22)18-24-19-30-27(26-7-3-5-21-4-1-2-6-25(21)26)31(24)23-12-14-28(15-13-23)32-16-17-33-28/h1-11,19,23H,12-18H2
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| InChIKey |
CBMWBVOLPFQNKP-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