General Information of the Compound
| Compound ID |
CP0479955
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| Compound Name |
(2S)-2-(2-benzoylanilino)-3-(4-phenyldiazenylphenyl)propanoic acid
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| Formula |
C28H23N3O3
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| Molecular Weight |
449.51
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| Canonical SMILES |
OC(=O)[C@H](Cc1ccc(cc1)\N=N/c1ccccc1)Nc1ccccc1C(=O)c1ccccc1
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| InChI |
InChI=1S/C28H23N3O3/c32-27(21-9-3-1-4-10-21)24-13-7-8-14-25(24)29-26(28(33)34)19-20-15-17-23(18-16-20)31-30-22-11-5-2-6-12-22/h1-18,26,29H,19H2,(H,33,34)/b31-30-/t26-/m0/s1
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| InChIKey |
IRHLQGNGQCQOJO-XTUDTMOTSA-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