General Information of the Compound
| Compound ID |
CP0461825
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| Compound Name |
4-(4-Methylpiperazin-1-yl)-6-(naphthalen-1-ylmethyl)-1,3,5-triazin-2-amine (12)
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| Structure |
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| Formula |
C19H22N6
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| Molecular Weight |
334.427
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| Canonical SMILES |
CN1CCN(CC1)c1nc(N)nc(Cc2cccc3ccccc23)n1
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| InChI |
InChI=1S/C19H22N6/c1-24-9-11-25(12-10-24)19-22-17(21-18(20)23-19)13-15-7-4-6-14-5-2-3-8-16(14)15/h2-8H,9-13H2,1H3,(H2,20,21,22,23)
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| InChIKey |
ZJCMJVPWMYOZEM-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