General Information of the Compound
| Compound ID |
CP0899211
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| Compound Name |
3-(4-(2'-Methoxybiphenyl-3-ylmethylamino)phenyl)propanoic acid
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| Structure |
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| Formula |
C23H23NO3
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| Molecular Weight |
361.441
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| Canonical SMILES |
COc1ccccc1-c1cccc(CNc2ccc(CCC(=O)O)cc2)c1
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| InChI |
InChI=1S/C23H23NO3/c1-27-22-8-3-2-7-21(22)19-6-4-5-18(15-19)16-24-20-12-9-17(10-13-20)11-14-23(25)26/h2-10,12-13,15,24H,11,14,16H2,1H3,(H,25,26)
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| InChIKey |
KRYGTGYIYKGNQR-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