General Information of the Compound
| Compound ID |
CP0490411
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| Compound Name |
N-(2,4-dichlorophenyl)-2-[[5-[[3-[2-(1,3-dioxolan-2-yl)ethyl]-4-oxophthalazin-1-yl]methyl]-4-methyl-1,2,4-triazol-3-yl]sulfanyl]acetamide
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| Formula |
C25H24Cl2N6O4S
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| Molecular Weight |
575.478
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| Canonical SMILES |
Cn1c(Cc2nn(CCC3OCCO3)c(=O)c3ccccc23)nnc1SCC(=O)Nc1ccc(Cl)cc1Cl
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| InChI |
InChI=1S/C25H24Cl2N6O4S/c1-32-21(29-30-25(32)38-14-22(34)28-19-7-6-15(26)12-18(19)27)13-20-16-4-2-3-5-17(16)24(35)33(31-20)9-8-23-36-10-11-37-23/h2-7,12,23H,8-11,13-14H2,1H3,(H,28,34)
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| InChIKey |
CAOVIZSTZKNRMK-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
Protein ID: PT07276, Interleukin-15
Protein ID: PT03663, Interleukin-15
Protein ID: PT03664, Interleukin-2