General Information of the Compound
| Compound ID |
CP0871310
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| Compound Name |
[2-(({[5-(4-methoxyphenyl)-1,2,4-triazin-3-yl]hydrazono}methyl)phenoxy]acetic acid
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| Structure |
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| Formula |
C19H17N5O4
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| Molecular Weight |
379.376
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| Canonical SMILES |
COc1ccc(-c2cnnc(N/N=C/c3ccccc3OCC(=O)O)n2)cc1
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| InChI |
InChI=1S/C19H17N5O4/c1-27-15-8-6-13(7-9-15)16-11-21-24-19(22-16)23-20-10-14-4-2-3-5-17(14)28-12-18(25)26/h2-11H,12H2,1H3,(H,25,26)(H,22,23,24)/b20-10+
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| InChIKey |
VKWBCXTWBIZSAM-KEBDBYFISA-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