General Information of the Compound
| Compound ID |
CP0383173
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| Compound Name |
2-[4-(5,9-diethoxy-6,8-dioxopyrrolo[3,4-g]quinolin-7-yl)phenyl]acetic acid
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| Structure |
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| Formula |
C23H20N2O6
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| Molecular Weight |
420.421
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| Canonical SMILES |
CCOc1c2C(=O)N(C(=O)c2c(OCC)c2ncccc12)c1ccc(CC(O)=O)cc1
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| InChI |
InChI=1S/C23H20N2O6/c1-3-30-20-15-6-5-11-24-19(15)21(31-4-2)18-17(20)22(28)25(23(18)29)14-9-7-13(8-10-14)12-16(26)27/h5-11H,3-4,12H2,1-2H3,(H,26,27)
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| InChIKey |
ACKUAQHWESHTCQ-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