General Information of the Compound
| Compound ID |
CP0384038
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| Compound Name |
methyl N-[4-chloro-3-[5-(trifluoromethyl)-1,3-benzoxazol-2-yl]phenyl]carbamate
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| Structure |
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| Formula |
C16H10ClF3N2O3
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| Molecular Weight |
370.714
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| Canonical SMILES |
COC(=O)Nc1ccc(Cl)c(c1)-c1nc2cc(ccc2o1)C(F)(F)F
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| InChI |
InChI=1S/C16H10ClF3N2O3/c1-24-15(23)21-9-3-4-11(17)10(7-9)14-22-12-6-8(16(18,19)20)2-5-13(12)25-14/h2-7H,1H3,(H,21,23)
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| InChIKey |
UFGQKCYKVGZBFQ-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