General Information of the Compound
| Compound ID |
CP0437816
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| Compound Name |
N-[5-(6-aminopyridazin-3-yl)-2,4-dimethylphenyl]-4-(pyridin-2-ylmethoxy)benzamide
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| Structure |
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| Formula |
C25H23N5O2
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| Molecular Weight |
425.492
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| Canonical SMILES |
Cc1cc(C)c(cc1NC(=O)c1ccc(OCc2ccccn2)cc1)-c1ccc(N)nn1
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| InChI |
InChI=1S/C25H23N5O2/c1-16-13-17(2)23(14-21(16)22-10-11-24(26)30-29-22)28-25(31)18-6-8-20(9-7-18)32-15-19-5-3-4-12-27-19/h3-14H,15H2,1-2H3,(H2,26,30)(H,28,31)
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| InChIKey |
XVERARALPOVGNI-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