General Information of the Compound
| Compound ID |
CP0560457
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| Compound Name |
N-methyl-N-[[6-(4-methylpiperazin-1-yl)-2-morpholin-4-ylpyrimidin-4-yl]methyl]-5,6,7,8-tetrahydroquinolin-8-amine
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| Structure |
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| Formula |
C24H35N7O
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| Molecular Weight |
437.592
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| Canonical SMILES |
CN(Cc1cc(nc(n1)N1CCOCC1)N1CCN(C)CC1)C1CCCc2cccnc12
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| InChI |
InChI=1S/C24H35N7O/c1-28-9-11-30(12-10-28)22-17-20(26-24(27-22)31-13-15-32-16-14-31)18-29(2)21-7-3-5-19-6-4-8-25-23(19)21/h4,6,8,17,21H,3,5,7,9-16,18H2,1-2H3
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| InChIKey |
PRZDJFKLMYQRHD-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