General Information of the Compound
| Compound ID |
CP0516891
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| Compound Name |
1-(Benzo[d][1,3]dioxole-6-carbonyl)-3-(3-chlorophenyl)-1-methylurea
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| Structure |
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| Formula |
C16H13ClN2O4
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| Molecular Weight |
332.743
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| Canonical SMILES |
CN(C(=O)Nc1cccc(Cl)c1)C(=O)c1ccc2OCOc2c1
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| InChI |
InChI=1S/C16H13ClN2O4/c1-19(16(21)18-12-4-2-3-11(17)8-12)15(20)10-5-6-13-14(7-10)23-9-22-13/h2-8H,9H2,1H3,(H,18,21)
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| InChIKey |
IZAUMBYPBQPFPK-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