General Information of the Compound
| Compound ID |
CP0415354
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| Compound Name |
8-[3-hydroxy-5-(2-methyloctan-2-yl)phenoxy]-N-[(2R)-1-hydroxypropan-2-yl]octanamide
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| Structure |
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| Formula |
C26H45NO4
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| Molecular Weight |
435.649
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| Canonical SMILES |
CCCCCCC(C)(C)c1cc(O)cc(OCCCCCCCC(=O)N[C@H](C)CO)c1
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| InChI |
InChI=1S/C26H45NO4/c1-5-6-7-12-15-26(3,4)22-17-23(29)19-24(18-22)31-16-13-10-8-9-11-14-25(30)27-21(2)20-28/h17-19,21,28-29H,5-16,20H2,1-4H3,(H,27,30)/t21-/m1/s1
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| InChIKey |
DYDSGKCYBXVVEY-OAQYLSRUSA-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