General Information of the Compound
| Compound ID |
CP0436833
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| Compound Name |
3-[[(E)-1-oxo-3-phenylprop-2-enyl]amino]benzoic acid
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| Structure |
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| Formula |
C16H13NO3
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| Molecular Weight |
267.284
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| Canonical SMILES |
OC(=O)c1cccc(NC(=O)\C=C\c2ccccc2)c1
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| InChI |
InChI=1S/C16H13NO3/c18-15(10-9-12-5-2-1-3-6-12)17-14-8-4-7-13(11-14)16(19)20/h1-11H,(H,17,18)(H,19,20)/b10-9+
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| InChIKey |
RYDHSPJJPLZJMX-MDZDMXLPSA-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