General Information of the Compound
| Compound ID |
CP0487904
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| Compound Name |
3-(4-amino-4-methylpiperidin-1-yl)-6-(2,3-dichlorophenyl)-1,2,4-triazin-5-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 |
CC1(N)CCN(CC1)c1nnc(c(N)n1)-c1cccc(Cl)c1Cl
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| InChI |
InChI=1S/C15H18Cl2N6/c1-15(19)5-7-23(8-6-15)14-20-13(18)12(21-22-14)9-3-2-4-10(16)11(9)17/h2-4H,5-8,19H2,1H3,(H2,18,20,22)
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| InChIKey |
VTTSGEFPLPXNHH-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