General Information of the Compound
| Compound ID |
CP0516445
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| Compound Name |
1-(Benzo[d][1,3]dioxole-6-carbonyl)-3-(3-(trifluoromethyl)phenyl)urea
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| Structure |
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| Formula |
C16H11F3N2O4
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| Molecular Weight |
352.268
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| Canonical SMILES |
FC(F)(F)c1cccc(NC(=O)NC(=O)c2ccc3OCOc3c2)c1
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| InChI |
InChI=1S/C16H11F3N2O4/c17-16(18,19)10-2-1-3-11(7-10)20-15(23)21-14(22)9-4-5-12-13(6-9)25-8-24-12/h1-7H,8H2,(H2,20,21,22,23)
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| InChIKey |
IATNFTWHACUJIT-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