General Information of the Compound
| Compound ID |
CP0437172
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| Compound Name |
6-[(2S,5R)-2-(hydroxymethyl)-5-phenylmorpholin-4-yl]-4H-pyrido[3,2-b][1,4]oxazin-3-one
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| Structure |
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| Formula |
C18H19N3O4
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| Molecular Weight |
341.367
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| Canonical SMILES |
OC[C@@H]1CN([C@@H](CO1)c1ccccc1)c1ccc2OCC(=O)Nc2n1
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| InChI |
InChI=1S/C18H19N3O4/c22-9-13-8-21(14(10-24-13)12-4-2-1-3-5-12)16-7-6-15-18(19-16)20-17(23)11-25-15/h1-7,13-14,22H,8-11H2,(H,19,20,23)/t13-,14-/m0/s1
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| InChIKey |
LFDYQGVYJNXWSB-KBPBESRZSA-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