General Information of the Compound
| Compound ID |
CP0424471
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| Compound Name |
N'-[5-(2,4-dichlorophenyl)-3,6-diethylpyrazin-2-yl]-N,N-dimethyl-N'-propylethane-1,2-diamine
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| Structure |
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| Formula |
C21H30Cl2N4
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| Molecular Weight |
409.405
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| Canonical SMILES |
CCCN(CCN(C)C)c1nc(CC)c(nc1CC)-c1ccc(Cl)cc1Cl
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| InChI |
InChI=1S/C21H30Cl2N4/c1-6-11-27(13-12-26(4)5)21-19(8-3)24-20(18(7-2)25-21)16-10-9-15(22)14-17(16)23/h9-10,14H,6-8,11-13H2,1-5H3
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| InChIKey |
ZHKYGVSCOALUME-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