General Information of the Compound
| Compound ID |
CP0848362
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| Compound Name |
1-(4-(2-(diethylamino)ethoxy)phenyl)-3-(2-ethoxy-5-methylphenyl)urea
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| Structure |
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| Formula |
C22H31N3O3
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| Molecular Weight |
385.508
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| Canonical SMILES |
CCOc1ccc(C)cc1NC(=O)Nc1ccc(OCCN(CC)CC)cc1
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| InChI |
InChI=1S/C22H31N3O3/c1-5-25(6-2)14-15-28-19-11-9-18(10-12-19)23-22(26)24-20-16-17(4)8-13-21(20)27-7-3/h8-13,16H,5-7,14-15H2,1-4H3,(H2,23,24,26)
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| InChIKey |
ROTNLGRRPAPXHN-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