General Information of the Compound
| Compound ID |
CP0426058
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| Compound Name |
2-[3-(1,8-naphthyridin-2-yl)propyl]-5-[4-[3-(trifluoromethyl)phenyl]phenyl]-1,3,4-oxadiazole
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| Structure |
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| Formula |
C26H19F3N4O
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| Molecular Weight |
460.459
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| Canonical SMILES |
FC(F)(F)c1cccc(c1)-c1ccc(cc1)-c1nnc(CCCc2ccc3cccnc3n2)o1
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| InChI |
InChI=1S/C26H19F3N4O/c27-26(28,29)21-6-1-4-20(16-21)17-9-11-19(12-10-17)25-33-32-23(34-25)8-2-7-22-14-13-18-5-3-15-30-24(18)31-22/h1,3-6,9-16H,2,7-8H2
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| InChIKey |
DWARFXPBXZYWSX-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