General Information of the Compound
| Compound ID |
CP0526980
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| Compound Name |
1-(8-hydroxythiochromeno[4,3-b]indol-11(6H)-yl)ethanone
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| Structure |
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| Formula |
C17H13NO2S
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| Molecular Weight |
295.363
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| Canonical SMILES |
CC(=O)n1c-2c(CSc3ccccc-23)c2cc(O)ccc12
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| InChI |
InChI=1S/C17H13NO2S/c1-10(19)18-15-7-6-11(20)8-13(15)14-9-21-16-5-3-2-4-12(16)17(14)18/h2-8,20H,9H2,1H3
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| InChIKey |
NRIWHWOWZHTVRA-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