General Information of the Compound
| Compound ID |
CP0548694
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| Compound Name |
4-[(3,4-dichlorophenyl)methyl]-6-(4-methylpiperazin-1-yl)-1,3,5-triazin-2-amine
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| Structure |
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| Formula |
C15H18Cl2N6
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| Molecular Weight |
353.257
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| Canonical SMILES |
CN1CCN(CC1)c1nc(N)nc(Cc2ccc(Cl)c(Cl)c2)n1
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| InChI |
InChI=1S/C15H18Cl2N6/c1-22-4-6-23(7-5-22)15-20-13(19-14(18)21-15)9-10-2-3-11(16)12(17)8-10/h2-3,8H,4-7,9H2,1H3,(H2,18,19,20,21)
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| InChIKey |
KKTKUBOTCWEJGC-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