General Information of the Compound
| Compound ID |
CP0444896
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| Compound Name |
5-N-(3,5-dichloropyridin-2-yl)-3,6-diethyl-2-N-(1-phenylpropyl)pyrazine-2,5-diamine
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| Structure |
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| Formula |
C22H25Cl2N5
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| Molecular Weight |
430.383
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| Canonical SMILES |
CCC(Nc1nc(CC)c(Nc2ncc(Cl)cc2Cl)nc1CC)c1ccccc1
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| InChI |
InChI=1S/C22H25Cl2N5/c1-4-17(14-10-8-7-9-11-14)26-21-18(5-2)28-22(19(6-3)27-21)29-20-16(24)12-15(23)13-25-20/h7-13,17H,4-6H2,1-3H3,(H,26,27)(H,25,28,29)
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| InChIKey |
NIMHOJJVTQKDIQ-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