General Information of the Compound
| Compound ID |
CP0430214
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| Compound Name |
5-(4,4-Dimethyl-2-oxo-1,4-dihydro-2H-benzo[d][1,3]oxazin-6-yl)-1H-pyrrole-2-carbonitrile
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| Structure |
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| Formula |
C15H13N3O2
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| Molecular Weight |
267.288
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| Canonical SMILES |
CC1(C)OC(=O)Nc2ccc(cc12)-c1ccc([nH]1)C#N
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| InChI |
InChI=1S/C15H13N3O2/c1-15(2)11-7-9(12-6-4-10(8-16)17-12)3-5-13(11)18-14(19)20-15/h3-7,17H,1-2H3,(H,18,19)
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| InChIKey |
KUBMCHJRDVLYFG-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