General Information of the Compound
| Compound ID |
CP0492446
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| Compound Name |
N-(2,4-dichlorophenyl)-2-[[5-[[3-(3-hydroxypropyl)-4-oxophthalazin-1-yl]methyl]-4-methyl-1,2,4-triazol-3-yl]sulfanyl]acetamide
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| Formula |
C23H22Cl2N6O3S
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| Molecular Weight |
533.441
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| Canonical SMILES |
Cn1c(Cc2nn(CCCO)c(=O)c3ccccc23)nnc1SCC(=O)Nc1ccc(Cl)cc1Cl
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| InChI |
InChI=1S/C23H22Cl2N6O3S/c1-30-20(12-19-15-5-2-3-6-16(15)22(34)31(29-19)9-4-10-32)27-28-23(30)35-13-21(33)26-18-8-7-14(24)11-17(18)25/h2-3,5-8,11,32H,4,9-10,12-13H2,1H3,(H,26,33)
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| InChIKey |
HDAVYAJNOJTKBR-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