General Information of the Compound
| Compound ID |
CP0507792
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| Compound Name |
3-[[4-[(E)-C-methyl-N-[(4-phenylphenyl)methoxy]carbonimidoyl]phenyl]methylamino]propanoic acid
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| Structure |
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| Formula |
C25H26N2O3
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| Molecular Weight |
402.494
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| Canonical SMILES |
C\C(=N/OCc1ccc(cc1)-c1ccccc1)c1ccc(CNCCC(O)=O)cc1
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| InChI |
InChI=1S/C25H26N2O3/c1-19(22-11-7-20(8-12-22)17-26-16-15-25(28)29)27-30-18-21-9-13-24(14-10-21)23-5-3-2-4-6-23/h2-14,26H,15-18H2,1H3,(H,28,29)/b27-19+
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| InChIKey |
PWPIIHLTBNNXGM-ZXVVBBHZSA-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