General Information of the Compound
| Compound ID |
CP0946268
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| Compound Name |
5-Benzyl-N-isopropyl-2-pyridin-2-yl-pyrimidine-4,6-diamine
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| Structure |
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| Formula |
C19H21N5
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| Molecular Weight |
319.412
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| Canonical SMILES |
CC(C)Nc1nc(-c2ccccn2)nc(N)c1Cc1ccccc1
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| InChI |
InChI=1S/C19H21N5/c1-13(2)22-18-15(12-14-8-4-3-5-9-14)17(20)23-19(24-18)16-10-6-7-11-21-16/h3-11,13H,12H2,1-2H3,(H3,20,22,23,24)
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| InChIKey |
UPBNHTDUGJSCEI-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