General Information of the Compound
| Compound ID |
CP0422977
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| Compound Name |
(Z)-1-((6-Methoxybenzo[b]thiophen-3-yl)methylene)-6-methyl-4-thioxo-4,5-dihydrofuro[3,4-c]pyridin-3(1H)-one
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| Structure |
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| Formula |
C18H13NO3S2
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| Molecular Weight |
355.44
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| Canonical SMILES |
COc1ccc2c(\C=C3/OC(=O)c4c3cc(C)[nH]c4=S)csc2c1
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| InChI |
InChI=1S/C18H13NO3S2/c1-9-5-13-14(22-18(20)16(13)17(23)19-9)6-10-8-24-15-7-11(21-2)3-4-12(10)15/h3-8H,1-2H3,(H,19,23)/b14-6-
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| InChIKey |
IJPHSSTZZYSTEG-NSIKDUERSA-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