General Information of the Compound
| Compound ID |
CP0577757
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| Compound Name |
N-[3-(5-chloro-1,3-benzoxazol-2-yl)phenyl]-2-(3-methoxyphenyl)acetamide
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| Structure |
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| Formula |
C22H17ClN2O3
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| Molecular Weight |
392.842
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| Canonical SMILES |
COc1cccc(CC(=O)Nc2cccc(c2)-c2nc3cc(Cl)ccc3o2)c1
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| InChI |
InChI=1S/C22H17ClN2O3/c1-27-18-7-2-4-14(10-18)11-21(26)24-17-6-3-5-15(12-17)22-25-19-13-16(23)8-9-20(19)28-22/h2-10,12-13H,11H2,1H3,(H,24,26)
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| InChIKey |
FLGRNWVSQKCHDU-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