General Information of the Compound
| Compound ID |
CP0528715
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| Compound Name |
5-(2,4-dichlorophenyl)-N-(1,3-dimethoxypropan-2-yl)-3,6-diethylpyrazin-2-amine
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| Structure |
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| Formula |
C19H25Cl2N3O2
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| Molecular Weight |
398.334
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| Canonical SMILES |
CCc1nc(c(CC)nc1NC(COC)COC)-c1ccc(Cl)cc1Cl
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| InChI |
InChI=1S/C19H25Cl2N3O2/c1-5-16-18(14-8-7-12(20)9-15(14)21)23-17(6-2)19(24-16)22-13(10-25-3)11-26-4/h7-9,13H,5-6,10-11H2,1-4H3,(H,22,24)
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| InChIKey |
MRAOCPQMEZUUIQ-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