General Information of the Compound
| Compound ID |
CP0479502
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| Compound Name |
N-methyl-3-(4-methylpiperazin-1-yl)isoquinolin-1-amine
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| Structure |
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| Formula |
C15H20N4
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| Molecular Weight |
256.353
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| Canonical SMILES |
CNc1nc(cc2ccccc12)N1CCN(C)CC1
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| InChI |
InChI=1S/C15H20N4/c1-16-15-13-6-4-3-5-12(13)11-14(17-15)19-9-7-18(2)8-10-19/h3-6,11H,7-10H2,1-2H3,(H,16,17)
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| InChIKey |
WJMAMTPJNQQNJJ-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