General Information of the Compound
| Compound ID |
CP0436465
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| Compound Name |
morpholin-4-yl-[4-[4-(trifluoromethyl)phenyl]-6,7-dihydro-4H-thieno[3,2-c]pyridin-5-yl]methanone
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| Structure |
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| Formula |
C19H19F3N2O2S
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| Molecular Weight |
396.434
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| Canonical SMILES |
FC(F)(F)c1ccc(cc1)C1N(CCc2sccc12)C(=O)N1CCOCC1
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| InChI |
InChI=1S/C19H19F3N2O2S/c20-19(21,22)14-3-1-13(2-4-14)17-15-6-12-27-16(15)5-7-24(17)18(25)23-8-10-26-11-9-23/h1-4,6,12,17H,5,7-11H2
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| InChIKey |
ABUIKYFOWXUFJZ-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