General Information of the Compound
| Compound ID |
CP0422000
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| Compound Name |
6-methyl-2-(pyridin-2-ylethynyl)-7,8-dihydro-1,6-naphthyridin-5(6H)-one
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| Structure |
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| Formula |
C16H13N3O
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| Molecular Weight |
263.3
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| Canonical SMILES |
CN1CCc2nc(ccc2C1=O)C#Cc1ccccn1
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| InChI |
InChI=1S/C16H13N3O/c1-19-11-9-15-14(16(19)20)8-7-13(18-15)6-5-12-4-2-3-10-17-12/h2-4,7-8,10H,9,11H2,1H3
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| InChIKey |
XAFARXNNTARHCK-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