General Information of the Compound
| Compound ID |
CP0323382
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| Compound Name |
(E)-3-(8-fluoro-6,12-dioxoindolo[2,1-b]quinazolin-2-yl)prop-2-enoic acid
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| Structure |
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| Formula |
C18H9FN2O4
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| Molecular Weight |
336.278
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| Canonical SMILES |
OC(=O)\C=C\c1ccc2nc3C(=O)c4cc(F)ccc4-n3c(=O)c2c1
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| InChI |
InChI=1S/C18H9FN2O4/c19-10-3-5-14-12(8-10)16(24)17-20-13-4-1-9(2-6-15(22)23)7-11(13)18(25)21(14)17/h1-8H,(H,22,23)/b6-2+
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| InChIKey |
GKMKNKXSNDAZJT-QHHAFSJGSA-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