General Information of the Compound
| Compound ID |
CP0461039
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| Compound Name |
8-Fluoro-1-oxo-1,2-dihydro-6H-pyrrolo[3,2,1-de]acridine-2-carboxylic acid (5-methyl-thiazol-2-yl)-amide
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| Structure |
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| Formula |
C20H14FN3O2S
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| Molecular Weight |
379.416
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| Canonical SMILES |
Cc1cnc(NC(=O)C2C(=O)N3c4c2cccc4Cc2cc(F)ccc32)s1
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| InChI |
InChI=1S/C20H14FN3O2S/c1-10-9-22-20(27-10)23-18(25)16-14-4-2-3-11-7-12-8-13(21)5-6-15(12)24(17(11)14)19(16)26/h2-6,8-9,16H,7H2,1H3,(H,22,23,25)
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| InChIKey |
KAKKGJNQTKAXMV-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