General Information of the Compound
| Compound ID |
CP0516876
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| Compound Name |
N-[1-[4-[4-(3-butoxyphenoxy)phenyl]phenyl]ethyl]acetamide
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| Formula |
C26H29NO3
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| Molecular Weight |
403.522
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| Canonical SMILES |
CCCCOc1cccc(Oc2ccc(cc2)-c2ccc(cc2)C(C)NC(C)=O)c1
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| InChI |
InChI=1S/C26H29NO3/c1-4-5-17-29-25-7-6-8-26(18-25)30-24-15-13-23(14-16-24)22-11-9-21(10-12-22)19(2)27-20(3)28/h6-16,18-19H,4-5,17H2,1-3H3,(H,27,28)
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| InChIKey |
DUKFRDNKSGBHSX-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
Protein ID: PT01270, Acetyl-CoA carboxylase 1
Protein ID: PT01119, Acetyl-CoA carboxylase 2