General Information of the Compound
| Compound ID |
CP0938836
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| Compound Name |
7-methoxy-4-((6-(3-methylisothiazol-5-yl)-[1,2,4]triazolo[4,3-b]pyridazin-3-yl)methoxy)quinoline
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| Structure |
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| Formula |
C16H13N5OS
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| Molecular Weight |
323.381
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| Canonical SMILES |
Cc1cc(-c2ccc3nnc(Cc4ccc(O)cc4)n3n2)sn1
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| InChI |
InChI=1S/C16H13N5OS/c1-10-8-14(23-20-10)13-6-7-15-17-18-16(21(15)19-13)9-11-2-4-12(22)5-3-11/h2-8,22H,9H2,1H3
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| InChIKey |
RJGVKCJCLAXBPM-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