General Information of the Compound
| Compound ID |
CP0421589
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| Compound Name |
(E)-N-[(4-tert-butylphenyl)methoxy]-1-(6-naphthalen-2-ylimidazo[2,1-b][1,3]oxazol-5-yl)methanimine
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| Structure |
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| Formula |
C27H25N3O2
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| Molecular Weight |
423.516
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| Canonical SMILES |
CC(C)(C)c1ccc(CO\N=C\c2c(nc3occn23)-c2ccc3ccccc3c2)cc1
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| InChI |
InChI=1S/C27H25N3O2/c1-27(2,3)23-12-8-19(9-13-23)18-32-28-17-24-25(29-26-30(24)14-15-31-26)22-11-10-20-6-4-5-7-21(20)16-22/h4-17H,18H2,1-3H3/b28-17+
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| InChIKey |
XAEMRWHYVDTZIJ-OGLMXYFKSA-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