General Information of the Compound
| Compound ID |
CP0492617
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| Compound Name |
(E)-3-[4-[(3-phenoxyphenyl)methylamino]phenyl]prop-2-enoic acid
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| Structure |
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| Formula |
C22H19NO3
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| Molecular Weight |
345.398
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| Canonical SMILES |
OC(=O)\C=C\c1ccc(NCc2cccc(Oc3ccccc3)c2)cc1
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| InChI |
InChI=1S/C22H19NO3/c24-22(25)14-11-17-9-12-19(13-10-17)23-16-18-5-4-8-21(15-18)26-20-6-2-1-3-7-20/h1-15,23H,16H2,(H,24,25)/b14-11+
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| InChIKey |
IWJSKYKXLNDIGK-SDNWHVSQSA-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