General Information of the Compound
| Compound ID |
CP0515469
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| Compound Name |
2-{2-[4-(6-Methyl-2-oxo-4H-benzo[d][1,3]oxazin-1-yl)-piperidin-1-yl]-acetylamino}-benzoic acid methyl ester
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| Structure |
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| Formula |
C24H27N3O5
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| Molecular Weight |
437.496
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| Canonical SMILES |
COC(=O)c1ccccc1NC(=O)CN1CCC(CC1)N1C(=O)OCc2cc(C)ccc12
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| InChI |
InChI=1S/C24H27N3O5/c1-16-7-8-21-17(13-16)15-32-24(30)27(21)18-9-11-26(12-10-18)14-22(28)25-20-6-4-3-5-19(20)23(29)31-2/h3-8,13,18H,9-12,14-15H2,1-2H3,(H,25,28)
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| InChIKey |
ZMUMCGCHCZBZEU-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