General Information of the Compound
| Compound ID |
CP0535444
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| Compound Name |
3,6-diethyl-N2-(pentan-3-yl)-N5-(2,4,6-trichlorophenyl)pyrazine-2,5-diamine
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| Structure |
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| Formula |
C19H25Cl3N4
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| Molecular Weight |
415.796
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| Canonical SMILES |
CCC(CC)Nc1nc(CC)c(Nc2c(Cl)cc(Cl)cc2Cl)nc1CC
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| InChI |
InChI=1S/C19H25Cl3N4/c1-5-12(6-2)23-18-15(7-3)25-19(16(8-4)24-18)26-17-13(21)9-11(20)10-14(17)22/h9-10,12H,5-8H2,1-4H3,(H,23,24)(H,25,26)
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| InChIKey |
UTONCNNCGVSCRX-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