General Information of the Compound
| Compound ID |
CP0416227
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| Compound Name |
2-[4-(2-aminoethoxy)-3-chlorophenyl]-N-[(4-tert-butylphenyl)methyl]propanamide
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| Structure |
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| Formula |
C22H29ClN2O2
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| Molecular Weight |
388.939
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| Canonical SMILES |
CC(C(=O)NCc1ccc(cc1)C(C)(C)C)c1ccc(OCCN)c(Cl)c1
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| InChI |
InChI=1S/C22H29ClN2O2/c1-15(17-7-10-20(19(23)13-17)27-12-11-24)21(26)25-14-16-5-8-18(9-6-16)22(2,3)4/h5-10,13,15H,11-12,14,24H2,1-4H3,(H,25,26)
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| InChIKey |
YCNLGWNCNYXVDZ-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