General Information of the Compound
| Compound ID |
CP0438441
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| Compound Name |
4-methyl-6-[3-(methylamino)azetidin-1-yl]pyrimidin-2-amine;dihydrochloride
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| Structure |
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| Formula |
C9H17Cl2N5
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| Molecular Weight |
266.176
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| Canonical SMILES |
Cl.Cl.CNC1CN(C1)c1cc(C)nc(N)n1
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| InChI |
InChI=1S/C9H15N5.2ClH/c1-6-3-8(13-9(10)12-6)14-4-7(5-14)11-2;;/h3,7,11H,4-5H2,1-2H3,(H2,10,12,13);2*1H
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| InChIKey |
CCMYRDFTJFOPOX-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