General Information of the Compound
| Compound ID |
CP0304033
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| Compound Name |
6-(5-fluoropyridin-3-yl)-2,2-dimethylspiro[1,3-dihydronaphthalene-4,4'-5H-1,3-oxazole]-2'-amine
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| Structure |
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| Formula |
C19H20FN3O
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| Molecular Weight |
325.387
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| Canonical SMILES |
CC1(C)Cc2ccc(cc2C2(COC(N)=N2)C1)-c1cncc(F)c1
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| InChI |
InChI=1S/C19H20FN3O/c1-18(2)7-13-4-3-12(14-5-15(20)9-22-8-14)6-16(13)19(10-18)11-24-17(21)23-19/h3-6,8-9H,7,10-11H2,1-2H3,(H2,21,23)
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| InChIKey |
GVUGSHHDPCGBJP-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