General Information of the Compound
| Compound ID |
CP0429558
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| Compound Name |
7-[(2R,5R)-5-(2-fluorophenyl)-2-methylmorpholin-4-yl]-1H-pyrido[3,4-b][1,4]oxazin-2-one
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| Structure |
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| Formula |
C18H18FN3O3
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| Molecular Weight |
343.358
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| Canonical SMILES |
C[C@@H]1CN([C@@H](CO1)c1ccccc1F)c1cc2NC(=O)COc2cn1
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| InChI |
InChI=1S/C18H18FN3O3/c1-11-8-22(15(9-24-11)12-4-2-3-5-13(12)19)17-6-14-16(7-20-17)25-10-18(23)21-14/h2-7,11,15H,8-10H2,1H3,(H,21,23)/t11-,15+/m1/s1
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| InChIKey |
BIWXPKQNQLRCJF-ABAIWWIYSA-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