General Information of the Compound
| Compound ID |
CP0577864
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| Compound Name |
2-[(3S)-7-fluoro-4-(2-oxo-1,4-dihydro-3,1-benzoxazine-7-carbonyl)-2,3-dihydro-1,4-benzoxazin-3-yl]-N-methylacetamide
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| Structure |
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| Formula |
C20H18FN3O5
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| Molecular Weight |
399.378
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| Canonical SMILES |
CNC(=O)C[C@H]1COc2cc(F)ccc2N1C(=O)c1ccc2COC(=O)Nc2c1
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| InChI |
InChI=1S/C20H18FN3O5/c1-22-18(25)8-14-10-28-17-7-13(21)4-5-16(17)24(14)19(26)11-2-3-12-9-29-20(27)23-15(12)6-11/h2-7,14H,8-10H2,1H3,(H,22,25)(H,23,27)/t14-/m0/s1
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| InChIKey |
MFJQMMMVDIDMNE-AWEZNQCLSA-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