General Information of the Compound
| Compound ID |
CP0497856
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| Compound Name |
2-[(3,4-difluorophenyl)methyl-[2-(3,4-dimethoxyphenoxy)ethyl]amino]-N-(2-methylpropyl)acetamide
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| Structure |
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| Formula |
C23H30F2N2O4
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| Molecular Weight |
436.499
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| Canonical SMILES |
COc1ccc(OCCN(CC(=O)NCC(C)C)Cc2ccc(F)c(F)c2)cc1OC
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| InChI |
InChI=1S/C23H30F2N2O4/c1-16(2)13-26-23(28)15-27(14-17-5-7-19(24)20(25)11-17)9-10-31-18-6-8-21(29-3)22(12-18)30-4/h5-8,11-12,16H,9-10,13-15H2,1-4H3,(H,26,28)
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| InChIKey |
WFOCTQOYUGMQEA-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