General Information of the Compound
| Compound ID |
CP0475628
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| Compound Name |
2-N-(cyclopropylmethyl)-6-[3-(methylamino)azetidin-1-yl]pyrimidine-2,4-diamine
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| Structure |
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| Formula |
C12H20N6
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| Molecular Weight |
248.334
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| Canonical SMILES |
CNC1CN(C1)c1cc(N)nc(NCC2CC2)n1
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| InChI |
InChI=1S/C12H20N6/c1-14-9-6-18(7-9)11-4-10(13)16-12(17-11)15-5-8-2-3-8/h4,8-9,14H,2-3,5-7H2,1H3,(H3,13,15,16,17)
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| InChIKey |
YXOUWCCLAZWGFC-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