General Information of the Compound
| Compound ID |
CP0487546
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| Compound Name |
N-methyl-5-[4-(2-propan-2-yloxyethyl)piperazin-1-yl]-7-(trifluoromethyl)thieno[3,2-b]pyridine-3-carboxamide
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| Structure |
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| Formula |
C19H25F3N4O2S
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| Molecular Weight |
430.496
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| Canonical SMILES |
CNC(=O)c1csc2c(cc(nc12)N1CCN(CCOC(C)C)CC1)C(F)(F)F
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| InChI |
InChI=1S/C19H25F3N4O2S/c1-12(2)28-9-8-25-4-6-26(7-5-25)15-10-14(19(20,21)22)17-16(24-15)13(11-29-17)18(27)23-3/h10-12H,4-9H2,1-3H3,(H,23,27)
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| InChIKey |
DDRUJRNOLSVDMR-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