General Information of the Compound
| Compound ID |
CP0505263
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| Compound Name |
1-(2-cyclopropyl-6-(3,3-dimethylazetidin-1-yl)-5-methylpyrimidin-4-yl)azepane
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| Structure |
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| Formula |
C19H30N4
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| Molecular Weight |
314.477
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| Canonical SMILES |
Cc1c(nc(nc1N1CCCCCC1)C1CC1)N1CC(C)(C)C1
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| InChI |
InChI=1S/C19H30N4/c1-14-17(22-10-6-4-5-7-11-22)20-16(15-8-9-15)21-18(14)23-12-19(2,3)13-23/h15H,4-13H2,1-3H3
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| InChIKey |
NCOBSULCEGPDAP-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