General Information of the Compound
| Compound ID |
CP0381643
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| Compound Name |
N-(cyclopropylmethyl)-11-[3-hydroxy-5-(2-methyloctan-2-yl)phenoxy]undecanamide
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| Structure |
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| Formula |
C30H51NO3
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| Molecular Weight |
473.742
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| Canonical SMILES |
CCCCCCC(C)(C)c1cc(O)cc(OCCCCCCCCCCC(=O)NCC2CC2)c1
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| InChI |
InChI=1S/C30H51NO3/c1-4-5-6-14-19-30(2,3)26-21-27(32)23-28(22-26)34-20-15-12-10-8-7-9-11-13-16-29(33)31-24-25-17-18-25/h21-23,25,32H,4-20,24H2,1-3H3,(H,31,33)
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| InChIKey |
XLXFHIMMQKILJI-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