General Information of the Compound
| Compound ID |
CP0524024
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| Compound Name |
6-((4,5-dimethyloxazol-2-ylthio)methyl)-N-((6-(methoxymethyl)pyridin-2-yl)methyl)-4-morpholinopyridin-2-amine
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| Structure |
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| Formula |
C23H29N5O3S
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| Molecular Weight |
455.584
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| Canonical SMILES |
COCc1cccc(CNc2cc(cc(CSc3nc(C)c(C)o3)n2)N2CCOCC2)n1
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| InChI |
InChI=1S/C23H29N5O3S/c1-16-17(2)31-23(25-16)32-15-20-11-21(28-7-9-30-10-8-28)12-22(27-20)24-13-18-5-4-6-19(26-18)14-29-3/h4-6,11-12H,7-10,13-15H2,1-3H3,(H,24,27)
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| InChIKey |
VDMGQNAZWGZLSQ-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