General Information of the Compound
| Compound ID |
CP0514741
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| Compound Name |
N-[2-(4-chlorophenyl)ethyl]-N-(1,4-dioxaspiro[4.5]decan-8-yl)-2-(methoxymethyl)benzamide
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| Structure |
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| Formula |
C25H30ClNO4
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| Molecular Weight |
443.971
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| Canonical SMILES |
COCc1ccccc1C(=O)N(CCc1ccc(Cl)cc1)C1CCC2(CC1)OCCO2
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| InChI |
InChI=1S/C25H30ClNO4/c1-29-18-20-4-2-3-5-23(20)24(28)27(15-12-19-6-8-21(26)9-7-19)22-10-13-25(14-11-22)30-16-17-31-25/h2-9,22H,10-18H2,1H3
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| InChIKey |
ZIQBTEHAGKTCCC-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