General Information of the Compound
| Compound ID |
CP0517449
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| Compound Name |
N-[2-(4-chlorophenyl)ethyl]-N-(1,4-dioxaspiro[4.5]decan-8-yl)-2-ethylbenzamide
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| Structure |
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| Formula |
C25H30ClNO3
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| Molecular Weight |
427.972
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| Canonical SMILES |
CCc1ccccc1C(=O)N(CCc1ccc(Cl)cc1)C1CCC2(CC1)OCCO2
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| InChI |
InChI=1S/C25H30ClNO3/c1-2-20-5-3-4-6-23(20)24(28)27(16-13-19-7-9-21(26)10-8-19)22-11-14-25(15-12-22)29-17-18-30-25/h3-10,22H,2,11-18H2,1H3
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| InChIKey |
VOFYNVHKDAYHLU-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