General Information of the Compound
| Compound ID |
CP0956052
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| Compound Name |
3-(4-(2-fluoro-4-methoxybenzyl)piperazin-1-yl)-N-isopropyl-7-methylpyrido[3,4-b]pyrazin-2-amine
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| Structure |
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| Formula |
C23H29FN6O
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| Molecular Weight |
424.524
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| Canonical SMILES |
COc1ccc(CN2CCN(c3nc4cnc(C)cc4nc3NC(C)C)CC2)c(F)c1
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| InChI |
InChI=1S/C23H29FN6O/c1-15(2)26-22-23(28-21-13-25-16(3)11-20(21)27-22)30-9-7-29(8-10-30)14-17-5-6-18(31-4)12-19(17)24/h5-6,11-13,15H,7-10,14H2,1-4H3,(H,26,27)
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| InChIKey |
WJMKLKVBDADQSR-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