General Information of the Compound
| Compound ID |
CP0397075
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| Compound Name |
2-[2-(2-methoxyphenyl)ethynyl]-6,7-dihydro-5H-[1,3]thiazolo[5,4-c]pyridin-4-one
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| Structure |
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| Formula |
C15H12N2O2S
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| Molecular Weight |
284.34
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| Canonical SMILES |
COc1ccccc1C#Cc1nc2CCNC(=O)c2s1
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| InChI |
InChI=1S/C15H12N2O2S/c1-19-12-5-3-2-4-10(12)6-7-13-17-11-8-9-16-15(18)14(11)20-13/h2-5H,8-9H2,1H3,(H,16,18)
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| InChIKey |
SDVOZACPIDOGAV-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