General Information of the Compound
| Compound ID |
CP0538867
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| Compound Name |
5-(4-chlorobenzyl)-2-(3-methoxyphenyl)-1-(1,4-dioxaspiro[4.5]decan-8-yl)-1H-imidazole
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| Structure |
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| Formula |
C25H27ClN2O3
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| Molecular Weight |
438.955
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| Canonical SMILES |
COc1cccc(c1)-c1ncc(Cc2ccc(Cl)cc2)n1C1CCC2(CC1)OCCO2
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| InChI |
InChI=1S/C25H27ClN2O3/c1-29-23-4-2-3-19(16-23)24-27-17-22(15-18-5-7-20(26)8-6-18)28(24)21-9-11-25(12-10-21)30-13-14-31-25/h2-8,16-17,21H,9-15H2,1H3
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| InChIKey |
LRIIIXSAXXTARY-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