General Information of the Compound
| Compound ID |
CP0151570
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| Compound Name |
2-(1,3-dioxo-5-(p-tolyloxy)isoindolin-2-yl)acetic acid
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| Structure |
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| Formula |
C17H13NO5
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| Molecular Weight |
311.293
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| Canonical SMILES |
Cc1ccc(Oc2ccc3C(=O)N(CC(O)=O)C(=O)c3c2)cc1
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| InChI |
InChI=1S/C17H13NO5/c1-10-2-4-11(5-3-10)23-12-6-7-13-14(8-12)17(22)18(16(13)21)9-15(19)20/h2-8H,9H2,1H3,(H,19,20)
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| InChIKey |
ZPEBYGRZMWFEJS-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