General Information of the Compound
| Compound ID |
CP0504186
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| Compound Name |
1-[(Z)-2-(2,4-Dimethoxy-phenyl)-2-isopropoxy-vinyl]-1H-[1,2,4]triazole
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| Structure |
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| Formula |
C15H19N3O3
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| Molecular Weight |
289.335
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| Canonical SMILES |
COc1ccc(\C(OC(C)C)=C\n2cncn2)c(OC)c1
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| InChI |
InChI=1S/C15H19N3O3/c1-11(2)21-15(8-18-10-16-9-17-18)13-6-5-12(19-3)7-14(13)20-4/h5-11H,1-4H3/b15-8-
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| InChIKey |
RNAAHOKAHUYKJW-NVNXTCNLSA-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