General Information of the Compound
| Compound ID |
CP0456479
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| Compound Name |
(+)-6-(azepan-1-yl)-N-cyclopropyl-2-(2-methylcyclopropyl)pyrimidin-4-amine
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| Structure |
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| Formula |
C17H26N4
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| Molecular Weight |
286.423
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| Canonical SMILES |
C[C@@H]1C[C@H]1c1nc(NC2CC2)cc(n1)N1CCCCCC1
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| InChI |
InChI=1S/C17H26N4/c1-12-10-14(12)17-19-15(18-13-6-7-13)11-16(20-17)21-8-4-2-3-5-9-21/h11-14H,2-10H2,1H3,(H,18,19,20)/t12-,14-/m1/s1
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| InChIKey |
JADYFZLYBMTREE-TZMCWYRMSA-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