General Information of the Compound
| Compound ID |
CP0914254
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| Compound Name |
6-methyl-4-(4-methylpiperazin-1-yl)-2-(trifluoromethyl)quinoline
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| Structure |
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| Formula |
C16H18F3N3
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| Molecular Weight |
309.335
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| Canonical SMILES |
Cc1ccc2nc(C(F)(F)F)cc(N3CCN(C)CC3)c2c1
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| InChI |
InChI=1S/C16H18F3N3/c1-11-3-4-13-12(9-11)14(10-15(20-13)16(17,18)19)22-7-5-21(2)6-8-22/h3-4,9-10H,5-8H2,1-2H3
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| InChIKey |
BSZQQQLYPGVRIY-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