General Information of the Compound
| Compound ID |
CP0515507
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| Compound Name |
N-(6-methoxyquinolin-2-yl)-2-[(4-oxo-3-phenyl-6,7-dihydrothieno[3,2-d]pyrimidin-2-yl)sulfanyl]acetamide
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| Structure |
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| Formula |
C24H20N4O3S2
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| Molecular Weight |
476.583
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| Canonical SMILES |
COc1ccc2nc(NC(=O)CSc3nc4CCSc4c(=O)n3-c3ccccc3)ccc2c1
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| InChI |
InChI=1S/C24H20N4O3S2/c1-31-17-8-9-18-15(13-17)7-10-20(25-18)27-21(29)14-33-24-26-19-11-12-32-22(19)23(30)28(24)16-5-3-2-4-6-16/h2-10,13H,11-12,14H2,1H3,(H,25,27,29)
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| InChIKey |
UIYPFRWLHXVHMZ-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