General Information of the Compound
| Compound ID |
CP0544667
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| Compound Name |
3-[[(2R)-oxolan-2-yl]methyl]-N-(2-pyrazol-1-ylethyl)-5-(trifluoromethyl)triazolo[4,5-d]pyrimidin-7-amine
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| Structure |
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| Formula |
C15H17F3N8O
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| Molecular Weight |
382.35
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| Canonical SMILES |
FC(F)(F)c1nc(NCCn2cccn2)c2nnn(C[C@H]3CCCO3)c2n1
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| InChI |
InChI=1S/C15H17F3N8O/c16-15(17,18)14-21-12(19-5-7-25-6-2-4-20-25)11-13(22-14)26(24-23-11)9-10-3-1-8-27-10/h2,4,6,10H,1,3,5,7-9H2,(H,19,21,22)/t10-/m1/s1
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| InChIKey |
TXNZHXFSKPFILI-SNVBAGLBSA-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