General Information of the Compound
| Compound ID |
CP0518581
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| Compound Name |
1-(Benzo[d][1,3]dioxole-6-carbonyl)-3-(3-chlorophenyl)-1,3-dimethylurea
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| Structure |
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| Formula |
C17H15ClN2O4
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| Molecular Weight |
346.77
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| Canonical SMILES |
CN(C(=O)N(C)c1cccc(Cl)c1)C(=O)c1ccc2OCOc2c1
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| InChI |
InChI=1S/C17H15ClN2O4/c1-19(13-5-3-4-12(18)9-13)17(22)20(2)16(21)11-6-7-14-15(8-11)24-10-23-14/h3-9H,10H2,1-2H3
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| InChIKey |
MOSCZDBBLMLSFK-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