General Information of the Compound
| Compound ID |
CP0578246
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| Compound Name |
4-[3-(dimethylamino)azetidin-1-yl]-6-propan-2-ylpyrimidin-2-amine
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| Structure |
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| Formula |
C12H21N5
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| Molecular Weight |
235.335
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| Canonical SMILES |
CC(C)c1cc(nc(N)n1)N1CC(C1)N(C)C
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| InChI |
InChI=1S/C12H21N5/c1-8(2)10-5-11(15-12(13)14-10)17-6-9(7-17)16(3)4/h5,8-9H,6-7H2,1-4H3,(H2,13,14,15)
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| InChIKey |
YPBPWSIJZRPMHU-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