General Information of the Compound
| Compound ID |
CP0477973
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| Compound Name |
5-N-(3,5-dichloropyridin-2-yl)-2-N-(1,3-dimethoxypropan-2-yl)-3,6-diethylpyrazine-2,5-diamine
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| Structure |
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| Formula |
C18H25Cl2N5O2
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| Molecular Weight |
414.337
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| Canonical SMILES |
CCc1nc(Nc2ncc(Cl)cc2Cl)c(CC)nc1NC(COC)COC
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| InChI |
InChI=1S/C18H25Cl2N5O2/c1-5-14-17(22-12(9-26-3)10-27-4)23-15(6-2)18(24-14)25-16-13(20)7-11(19)8-21-16/h7-8,12H,5-6,9-10H2,1-4H3,(H,22,23)(H,21,24,25)
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| InChIKey |
BPRPWSIDDAZAMV-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