General Information of the Compound
| Compound ID |
CP0523509
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| Compound Name |
3-(4-ethylpiperazin-1-yl)sulfonyl-6-[5-(trifluoromethyl)pyridin-3-yl]imidazo[1,2-b]pyridazine
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| Structure |
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| Formula |
C18H19F3N6O2S
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| Molecular Weight |
440.451
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| Canonical SMILES |
CCN1CCN(CC1)S(=O)(=O)c1cnc2ccc(nn12)-c1cncc(c1)C(F)(F)F
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| InChI |
InChI=1S/C18H19F3N6O2S/c1-2-25-5-7-26(8-6-25)30(28,29)17-12-23-16-4-3-15(24-27(16)17)13-9-14(11-22-10-13)18(19,20)21/h3-4,9-12H,2,5-8H2,1H3
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| InChIKey |
FGDKWPNKPDYNCE-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