General Information of the Compound
| Compound ID |
CP0202145
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| Compound Name |
N-[1-[3-[[4-[3-(cyclopropylmethoxy)phenoxy]phenyl]methoxy]phenyl]ethyl]acetamide
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| Structure |
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| Formula |
C27H29NO4
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| Molecular Weight |
431.532
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| Canonical SMILES |
CC(NC(C)=O)c1cccc(OCc2ccc(Oc3cccc(OCC4CC4)c3)cc2)c1
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| InChI |
InChI=1S/C27H29NO4/c1-19(28-20(2)29)23-5-3-6-25(15-23)30-18-22-11-13-24(14-12-22)32-27-8-4-7-26(16-27)31-17-21-9-10-21/h3-8,11-16,19,21H,9-10,17-18H2,1-2H3,(H,28,29)
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| InChIKey |
YOOKLZGTYFTMMB-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