General Information of the Compound
| Compound ID |
CP0407052
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| Compound Name |
oxolan-2-yl-[2-(2-phenylethynyl)-6,7-dihydro-4H-[1,3]thiazolo[5,4-c]pyridin-5-yl]methanone
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| Structure |
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| Formula |
C19H18N2O2S
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| Molecular Weight |
338.432
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| Canonical SMILES |
O=C(C1CCCO1)N1CCc2nc(sc2C1)C#Cc1ccccc1
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| InChI |
InChI=1S/C19H18N2O2S/c22-19(16-7-4-12-23-16)21-11-10-15-17(13-21)24-18(20-15)9-8-14-5-2-1-3-6-14/h1-3,5-6,16H,4,7,10-13H2
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| InChIKey |
BCAYLBZLRCQCJZ-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