General Information of the Compound
| Compound ID |
CP0541422
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| Compound Name |
(R)-2-(6-(benzyloxy)-1,2,3,4-tetrahydronaphthalene-2-carbonyl)oxazole-5-carbonitrile
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| Structure |
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| Formula |
C22H18N2O3
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| Molecular Weight |
358.397
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| Canonical SMILES |
O=C([C@@H]1CCc2cc(OCc3ccccc3)ccc2C1)c1ncc(o1)C#N
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| InChI |
InChI=1S/C22H18N2O3/c23-12-20-13-24-22(27-20)21(25)18-7-6-17-11-19(9-8-16(17)10-18)26-14-15-4-2-1-3-5-15/h1-5,8-9,11,13,18H,6-7,10,14H2/t18-/m1/s1
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| InChIKey |
MGLKICUYHKUUSH-GOSISDBHSA-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