General Information of the Compound
| Compound ID |
CP0416471
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| Compound Name |
N-(4-propan-2-ylpiperazin-1-yl)-N-(pyrimidin-4-ylmethyl)-5,6,7,8-tetrahydroquinolin-8-amine
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| Structure |
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| Formula |
C21H30N6
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| Molecular Weight |
366.513
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| Canonical SMILES |
CC(C)N1CCN(CC1)N(Cc1ccncn1)C1CCCc2cccnc12
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| InChI |
InChI=1S/C21H30N6/c1-17(2)25-11-13-26(14-12-25)27(15-19-8-10-22-16-24-19)20-7-3-5-18-6-4-9-23-21(18)20/h4,6,8-10,16-17,20H,3,5,7,11-15H2,1-2H3
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| InChIKey |
OXYOGGMFEOPAMV-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