General Information of the Compound
| Compound ID |
CP0557201
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| Compound Name |
1-methyl-3-(2-phenylethynyl)-4H-imidazo[5,1-c][1,4]benzoxazine
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| Structure |
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| Formula |
C19H14N2O
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| Molecular Weight |
286.334
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| Canonical SMILES |
Cc1nc(C#Cc2ccccc2)c2COc3ccccc3-n12
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| InChI |
InChI=1S/C19H14N2O/c1-14-20-16(12-11-15-7-3-2-4-8-15)18-13-22-19-10-6-5-9-17(19)21(14)18/h2-10H,13H2,1H3
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| InChIKey |
IKSIFHQALKJIHI-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