General Information of the Compound
| Compound ID |
CP0441264
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| Compound Name |
3-[2-(2-methylpyridin-4-yl)ethynyl]-4H-imidazo[5,1-c][1,4]benzoxazine
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| Structure |
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| Formula |
C18H13N3O
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| Molecular Weight |
287.322
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| Canonical SMILES |
Cc1cc(ccn1)C#Cc1ncn-2c1COc1ccccc-21
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| InChI |
InChI=1S/C18H13N3O/c1-13-10-14(8-9-19-13)6-7-15-17-11-22-18-5-3-2-4-16(18)21(17)12-20-15/h2-5,8-10,12H,11H2,1H3
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| InChIKey |
WCTCMHZWHMFZFN-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