General Information of the Compound
| Compound ID |
CP0576898
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| Compound Name |
2-[(2R)-6-fluoro-1-(3-oxo-4H-1,4-benzoxazine-6-carbonyl)-3,4-dihydro-2H-quinolin-2-yl]-N-methylacetamide
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| Structure |
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| Formula |
C21H20FN3O4
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| Molecular Weight |
397.406
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| Canonical SMILES |
CNC(=O)C[C@H]1CCc2cc(F)ccc2N1C(=O)c1ccc2OCC(=O)Nc2c1
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| InChI |
InChI=1S/C21H20FN3O4/c1-23-19(26)10-15-5-2-12-8-14(22)4-6-17(12)25(15)21(28)13-3-7-18-16(9-13)24-20(27)11-29-18/h3-4,6-9,15H,2,5,10-11H2,1H3,(H,23,26)(H,24,27)/t15-/m1/s1
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| InChIKey |
HHAHWQRMWXEINT-OAHLLOKOSA-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