General Information of the Compound
| Compound ID |
CP0487347
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| Compound Name |
4-[4-(2-phenylacetyl)phenyl]benzoic acid
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| Structure |
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| Formula |
C21H16O3
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| Molecular Weight |
316.356
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| Canonical SMILES |
OC(=O)c1ccc(cc1)-c1ccc(cc1)C(=O)Cc1ccccc1
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| InChI |
InChI=1S/C21H16O3/c22-20(14-15-4-2-1-3-5-15)18-10-6-16(7-11-18)17-8-12-19(13-9-17)21(23)24/h1-13H,14H2,(H,23,24)
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| InChIKey |
XXJJKZXRZYTVRN-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