General Information of the Compound
| Compound ID |
CP0362696
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| Compound Name |
N-[5-(2-methoxyphenoxy)-2-pyrimidin-2-yl-6-(2-pyrimidin-2-yloxyethoxy)pyrimidin-4-yl]-2-phenylethanesulfonamide
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| Structure |
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| Formula |
C29H27N7O6S
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| Molecular Weight |
601.645
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| Canonical SMILES |
COc1ccccc1Oc1c(NS(=O)(=O)CCc2ccccc2)nc(nc1OCCOc1ncccn1)-c1ncccn1
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| InChI |
InChI=1S/C29H27N7O6S/c1-39-22-11-5-6-12-23(22)42-24-25(36-43(37,38)20-13-21-9-3-2-4-10-21)34-27(26-30-14-7-15-31-26)35-28(24)40-18-19-41-29-32-16-8-17-33-29/h2-12,14-17H,13,18-20H2,1H3,(H,34,35,36)
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| InChIKey |
WSNWXTKIOPWVDW-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