General Information of the Compound
| Compound ID |
CP0578740
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| Compound Name |
N-methyl-N-[[6-(4-methylpiperazin-1-yl)-2-(propan-2-ylamino)pyrimidin-4-yl]methyl]-5,6,7,8-tetrahydroquinolin-8-amine
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| Structure |
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| Formula |
C23H35N7
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| Molecular Weight |
409.582
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| Canonical SMILES |
CC(C)Nc1nc(CN(C)C2CCCc3cccnc23)cc(n1)N1CCN(C)CC1
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| InChI |
InChI=1S/C23H35N7/c1-17(2)25-23-26-19(15-21(27-23)30-13-11-28(3)12-14-30)16-29(4)20-9-5-7-18-8-6-10-24-22(18)20/h6,8,10,15,17,20H,5,7,9,11-14,16H2,1-4H3,(H,25,26,27)
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| InChIKey |
UUAZXZMLXPBEGD-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