General Information of the Compound
| Compound ID |
CP0532351
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| Compound Name |
1-[(2-chlorophenyl)methyl]-5-(2,3-dimethoxyphenyl)tetrazole
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| Structure |
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| Formula |
C16H15ClN4O2
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| Molecular Weight |
330.775
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| Canonical SMILES |
COc1cccc(-c2nnnn2Cc2ccccc2Cl)c1OC
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| InChI |
InChI=1S/C16H15ClN4O2/c1-22-14-9-5-7-12(15(14)23-2)16-18-19-20-21(16)10-11-6-3-4-8-13(11)17/h3-9H,10H2,1-2H3
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| InChIKey |
OAVXXEZFXHHAQZ-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