General Information of the Compound
| Compound ID |
CP0529096
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| Compound Name |
4-[5-(1,5-dioxaspiro[5.5]undecan-9-yl)pentoxy]-N,N-dimethylbenzamide
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| Structure |
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| Formula |
C23H35NO4
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| Molecular Weight |
389.536
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| Canonical SMILES |
CN(C)C(=O)c1ccc(OCCCCCC2CCC3(CC2)OCCCO3)cc1
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| InChI |
InChI=1S/C23H35NO4/c1-24(2)22(25)20-8-10-21(11-9-20)26-16-5-3-4-7-19-12-14-23(15-13-19)27-17-6-18-28-23/h8-11,19H,3-7,12-18H2,1-2H3
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| InChIKey |
WYYMFMQWLHLSDU-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