General Information of the Compound
| Compound ID |
CP0553082
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| Compound Name |
1-butan-2-yl-7-[cyclohexyl(methyl)amino]-3-(4-methylpiperazin-1-yl)pyrido[3,4-b]pyrazin-2-one
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| Formula |
C23H36N6O
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| Molecular Weight |
412.582
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| Canonical SMILES |
CCC(C)n1c2cc(ncc2nc(N2CCN(C)CC2)c1=O)N(C)C1CCCCC1
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| InChI |
InChI=1S/C23H36N6O/c1-5-17(2)29-20-15-21(27(4)18-9-7-6-8-10-18)24-16-19(20)25-22(23(29)30)28-13-11-26(3)12-14-28/h15-18H,5-14H2,1-4H3
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| InChIKey |
OQRZEMUOCWKWPZ-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