General Information of the Compound
| Compound ID |
CP0383649
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| Compound Name |
5-(3-methylbutyl)-3-(oxan-2-ylmethyl)triazolo[4,5-d]pyrimidin-7-amine
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| Structure |
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| Formula |
C15H24N6O
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| Molecular Weight |
304.398
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| Canonical SMILES |
CC(C)CCc1nc(N)c2nnn(CC3CCCCO3)c2n1
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| InChI |
InChI=1S/C15H24N6O/c1-10(2)6-7-12-17-14(16)13-15(18-12)21(20-19-13)9-11-5-3-4-8-22-11/h10-11H,3-9H2,1-2H3,(H2,16,17,18)
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| InChIKey |
HYTXKGCTIGEWNU-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