General Information of the Compound
| Compound ID |
CP0559995
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| Compound Name |
N-[(3-methoxyphenyl)methyl]-6-[5-(trifluoromethyl)pyridin-3-yl]imidazo[1,2-b]pyridazine-3-sulfonamide
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| Structure |
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| Formula |
C20H16F3N5O3S
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| Molecular Weight |
463.441
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| Canonical SMILES |
COc1cccc(CNS(=O)(=O)c2cnc3ccc(nn23)-c2cncc(c2)C(F)(F)F)c1
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| InChI |
InChI=1S/C20H16F3N5O3S/c1-31-16-4-2-3-13(7-16)9-26-32(29,30)19-12-25-18-6-5-17(27-28(18)19)14-8-15(11-24-10-14)20(21,22)23/h2-8,10-12,26H,9H2,1H3
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| InChIKey |
CBWBHJWZPDFKSQ-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