General Information of the Compound
| Compound ID |
CP0848336
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| Compound Name |
1,3-bis(4-(2-(dimethylamino)ethyl)phenyl)urea
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| Structure |
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| Formula |
C21H30N4O
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| Molecular Weight |
354.498
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| Canonical SMILES |
CN(C)CCc1ccc(NC(=O)Nc2ccc(CCN(C)C)cc2)cc1
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| InChI |
InChI=1S/C21H30N4O/c1-24(2)15-13-17-5-9-19(10-6-17)22-21(26)23-20-11-7-18(8-12-20)14-16-25(3)4/h5-12H,13-16H2,1-4H3,(H2,22,23,26)
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| InChIKey |
LGRJDHSASBSOJL-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