General Information of the Compound
| Compound ID |
CP0857636
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| Compound Name |
1-(4-(3-(dimethylamino)propoxy)phenyl)-3-(2,3-dimethylphenyl)urea
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| Structure |
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| Formula |
C20H27N3O2
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| Molecular Weight |
341.455
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| Canonical SMILES |
Cc1cccc(NC(=O)Nc2ccc(OCCCN(C)C)cc2)c1C
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| InChI |
InChI=1S/C20H27N3O2/c1-15-7-5-8-19(16(15)2)22-20(24)21-17-9-11-18(12-10-17)25-14-6-13-23(3)4/h5,7-12H,6,13-14H2,1-4H3,(H2,21,22,24)
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| InChIKey |
BCEAVZMPLVFHMP-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