General Information of the Compound
| Compound ID |
CP0723695
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| Compound Name |
2-(2-(hydrazono(phenyl)methyl)phenylamino)-3-(4-(2-(methyl(pyridin-2-yl)amino)ethoxy)phenyl)propanoic acid
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| Structure |
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| Formula |
C30H31N5O3
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| Molecular Weight |
509.61
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| Canonical SMILES |
CN(CCOc1ccc(CC(Nc2ccccc2/C(=N/N)c2ccccc2)C(=O)O)cc1)c1ccccn1
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| InChI |
InChI=1S/C30H31N5O3/c1-35(28-13-7-8-18-32-28)19-20-38-24-16-14-22(15-17-24)21-27(30(36)37)33-26-12-6-5-11-25(26)29(34-31)23-9-3-2-4-10-23/h2-18,27,33H,19-21,31H2,1H3,(H,36,37)/b34-29+
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| InChIKey |
MZOMKUYJYYAAQK-RIHQVDFKSA-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