General Information of the Compound
| Compound ID |
CP0491830
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| Compound Name |
2,6-bis[(2-methylpropan-2-yl)oxy]-4-(4-phenyl-5-thiophen-2-yl-1H-imidazol-2-yl)phenol
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| Structure |
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| Formula |
C27H30N2O3S
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| Molecular Weight |
462.615
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| Canonical SMILES |
CC(C)(C)Oc1cc(cc(OC(C)(C)C)c1O)-c1nc(c([nH]1)-c1cccs1)-c1ccccc1
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| InChI |
InChI=1S/C27H30N2O3S/c1-26(2,3)31-19-15-18(16-20(24(19)30)32-27(4,5)6)25-28-22(17-11-8-7-9-12-17)23(29-25)21-13-10-14-33-21/h7-16,30H,1-6H3,(H,28,29)
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| InChIKey |
NPZZLWZYXORDAD-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