General Information of the Compound
| Compound ID |
CP0514756
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| Compound Name |
5-N-heptan-4-yl-3-methyl-2-N-(2,4,6-trimethylphenyl)quinoxaline-2,5-diamine
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| Structure |
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| Formula |
C25H34N4
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| Molecular Weight |
390.575
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| Canonical SMILES |
CCCC(CCC)Nc1cccc2nc(Nc3c(C)cc(C)cc3C)c(C)nc12
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| InChI |
InChI=1S/C25H34N4/c1-7-10-20(11-8-2)27-21-12-9-13-22-24(21)26-19(6)25(28-22)29-23-17(4)14-16(3)15-18(23)5/h9,12-15,20,27H,7-8,10-11H2,1-6H3,(H,28,29)
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| InChIKey |
RHFZDQJVDYKBHA-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