General Information of the Compound
| Compound ID |
CP0411358
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| Compound Name |
4-amino-3-(4-benzyl-3-oxoquinoxalin-2-yl)benzoic acid
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| Structure |
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| Formula |
C22H17N3O3
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| Molecular Weight |
371.396
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| Canonical SMILES |
Nc1ccc(cc1-c1nc2ccccc2n(Cc2ccccc2)c1=O)C(O)=O
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| InChI |
InChI=1S/C22H17N3O3/c23-17-11-10-15(22(27)28)12-16(17)20-21(26)25(13-14-6-2-1-3-7-14)19-9-5-4-8-18(19)24-20/h1-12H,13,23H2,(H,27,28)
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| InChIKey |
BJCJBSRJAAVGCI-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